N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine

C235H331N25O — CID 159257612

IUPACN,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.CCCCC(CCCC)c1ccnc(-c2cc(C(CCCC)CCCC)cc(-c3cc(C(CCCC)CCCC)ccn3)n2)c1.CCCCC(CCCC)c1ccnc(-c2cc(C(CCCC)CCCC)ccn2)c1.CCCCCCCCCCCCCCCCCCN(CCc1ccccn1)Cc1ccccn1.CCCCCCCCCCCCCCCCCCN(Cc1ccccn1)Cc1ccccn1.CCCCCCCCCc1ccnc(-c2cc(CCCCCCCCC)ccn2)c1.Cc1cc(C)nc(-c2cc(C)cc(C)n2)c1.Cc1ccc(-c2ccc(C)cn2)nc1.O=C(c1ccccn1)c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(Cc2ccccn2)nc1
InChIInChI=1S/C42H65N3.C31H51N3.C30H49N3.2C28H44N2.C18H24N2.C14H16N2.C12H12N2.C11H8N2O.C11H10N2.C10H8N2/c1-7-13-19-33(20-14-8-2)36-25-27-43-39(29-36)41-31-38(35(23-17-11-5)24-18-12-6)32-42(45-41)40-30-37(26-28-44-40)34(21-15-9-3)22-16-10-4;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-34(29-31-23-18-20-26-33-31)28-24-30-22-17-19-25-32-30;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-33(27-29-22-17-19-24-31-29)28-30-23-18-20-25-32-30;1-5-9-13-23(14-10-6-2)25-17-19-29-27(21-25)28-22-26(18-20-30-28)24(15-11-7-3)16-12-8-4;1-3-5-7-9-11-13-15-17-25-19-21-29-27(23-25)28-24-26(20-22-30-28)18-16-14-12-10-8-6-4-2;1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;1-9-5-11(3)15-13(7-9)14-8-10(2)6-12(4)16-14;1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12;14-11(9-5-1-3-7-12-9)10-6-2-4-8-13-10;1-3-7-12-10(5-1)9-11-6-2-4-8-13-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10/h25-35H,7-24H2,1-6H3;17-20,22-23,25-26H,2-16,21,24,27-29H2,1H3;17-20,22-25H,2-16,21,26-28H2,1H3;17-24H,5-16H2,1-4H3;19-24H,3-18H2,1-2H3;7-12H,1-6H3;5-8H,1-4H3;3-8H,1-2H3;1-8H;1-8H,9H2;1-8H
InChIKeyKWCDNEAYMLGQJX-UHFFFAOYSA-N
MW3522.41 g/mol
LogP65.72
Rot. Bonds106

About N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine

N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine (PubChem CID 159257612) has the molecular formula C235H331N25O and a molecular weight of 3522.41 g/mol. Its IUPAC name is N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine.

Molecular Properties

Compound NameN,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine
PubChem CID159257612
Molecular FormulaC235H331N25O
Molecular Weight3522.41 g/mol
Exact Mass3519.66
IUPAC NameN,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.CCCCC(CCCC)c1ccnc(-c2cc(C(CCCC)CCCC)cc(-c3cc(C(CCCC)CCCC)ccn3)n2)c1.CCCCC(CCCC)c1ccnc(-c2cc(C(CCCC)CCCC)ccn2)c1.CCCCCCCCCCCCCCCCCCN(CCc1ccccn1)Cc1ccccn1.CCCCCCCCCCCCCCCCCCN(Cc1ccccn1)Cc1ccccn1.CCCCCCCCCc1ccnc(-c2cc(CCCCCCCCC)ccn2)c1.Cc1cc(C)nc(-c2cc(C)cc(C)n2)c1.Cc1ccc(-c2ccc(C)cn2)nc1.O=C(c1ccccn1)c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(Cc2ccccn2)nc1
InChIInChI=1S/C42H65N3.C31H51N3.C30H49N3.2C28H44N2.C18H24N2.C14H16N2.C12H12N2.C11H8N2O.C11H10N2.C10H8N2/c1-7-13-19-33(20-14-8-2)36-25-27-43-39(29-36)41-31-38(35(23-17-11-5)24-18-12-6)32-42(45-41)40-30-37(26-28-44-40)34(21-15-9-3)22-16-10-4;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-34(29-31-23-18-20-26-33-31)28-24-30-22-17-19-25-32-30;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-33(27-29-22-17-19-24-31-29)28-30-23-18-20-25-32-30;1-5-9-13-23(14-10-6-2)25-17-19-29-27(21-25)28-22-26(18-20-30-28)24(15-11-7-3)16-12-8-4;1-3-5-7-9-11-13-15-17-25-19-21-29-27(23-25)28-24-26(20-22-30-28)18-16-14-12-10-8-6-4-2;1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;1-9-5-11(3)15-13(7-9)14-8-10(2)6-12(4)16-14;1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12;14-11(9-5-1-3-7-12-9)10-6-2-4-8-13-10;1-3-7-12-10(5-1)9-11-6-2-4-8-13-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10/h25-35H,7-24H2,1-6H3;17-20,22-23,25-26H,2-16,21,24,27-29H2,1H3;17-20,22-25H,2-16,21,26-28H2,1H3;17-24H,5-16H2,1-4H3;19-24H,3-18H2,1-2H3;7-12H,1-6H3;5-8H,1-4H3;3-8H,1-2H3;1-8H;1-8H,9H2;1-8H
InChIKeyKWCDNEAYMLGQJX-UHFFFAOYSA-N
XLogP65.72
TPSA320.02 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds106
Heavy Atoms261
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003522.41
LogP ≤ 565.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine?
The IUPAC name of N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine (CID 159257612) is N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine.
What is the SMILES notation for N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine?
The canonical SMILES for N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine is CC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.CCCCC(CCCC)c1ccnc(-c2cc(C(CCCC)CCCC)cc(-c3cc(C(CCCC)CCCC)ccn3)n2)c1.CCCCC(CCCC)c1ccnc(-c2cc(C(CCCC)CCCC)ccn2)c1.CCCCCCCCCCCCCCCCCCN(CCc1ccccn1)Cc1ccccn1.CCCCCCCCCCCCCCCCCCN(Cc1ccccn1)Cc1ccccn1.CCCCCCCCCc1ccnc(-c2cc(CCCCCCCCC)ccn2)c1.Cc1cc(C)nc(-c2cc(C)cc(C)n2)c1.Cc1ccc(-c2ccc(C)cn2)nc1.O=C(c1ccccn1)c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(Cc2ccccn2)nc1.
What is the InChIKey of N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine?
The InChIKey is KWCDNEAYMLGQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H65N3.C31H51N3.C30H49N3.2C28H44N2.C18H24N2.C14H16N2.C12H12N2.C11H8N2O.C11H10N2.C10H8N2/c1-7-13-19-33(20-14-8-2)36-25-27-43-39(29-36)41-31-38(35(23-17-11-5)24-18-12-6)32-42(45-41)40-30-37(26-28-44-40)34(21-15-9-3)22-16-10-4;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-27-34(29-31-23-18-20-26-33-31)28-24-30-22-17-19-25-32-30;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26-33(27-29-22-17-19-24-31-29)28-30-23-18-20-25-32-30;1-5-9-13-23(14-10-6-2)25-17-19-29-27(21-25)28-22-26(18-20-30-28)24(15-11-7-3)16-12-8-4;1-3-5-7-9-11-13-15-17-25-19-21-29-27(23-25)28-24-26(20-22-30-28)18-16-14-12-10-8-6-4-2;1-17(2,3)13-7-9-19-15(11-13)16-12-14(8-10-20-16)18(4,5)6;1-9-5-11(3)15-13(7-9)14-8-10(2)6-12(4)16-14;1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12;14-11(9-5-1-3-7-12-9)10-6-2-4-8-13-10;1-3-7-12-10(5-1)9-11-6-2-4-8-13-11;1-3-7-11-9(5-1)10-6-2-4-8-12-10/h25-35H,7-24H2,1-6H3;17-20,22-23,25-26H,2-16,21,24,27-29H2,1H3;17-20,22-25H,2-16,21,26-28H2,1H3;17-24H,5-16H2,1-4H3;19-24H,3-18H2,1-2H3;7-12H,1-6H3;5-8H,1-4H3;3-8H,1-2H3;1-8H;1-8H,9H2;1-8H.
What are the key properties of N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine?
N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine has a molecular weight of 3522.41 g/mol, XLogP of 65.72, 106 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(pyridin-2-ylmethyl)octadecan-1-amine;4-tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;2-(4,6-dimethyl-2-pyridinyl)-4,6-dimethylpyridine;dipyridin-2-ylmethanone;5-methyl-2-(5-methyl-2-pyridinyl)pyridine;4-nonan-5-yl-2,6-bis(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonan-5-yl-2-(4-nonan-5-yl-2-pyridinyl)pyridine;4-nonyl-2-(4-nonyl-2-pyridinyl)pyridine;N-(2-pyridin-2-ylethyl)-N-(pyridin-2-ylmethyl)octadecan-1-amine;2-(pyridin-2-ylmethyl)pyridine;2-pyridin-2-ylpyridine is sourced from PubChem (CID 159257612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).