2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine

C68H68N16O4 — CID 158286473

IUPAC2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine
SMILESCN(C)c1ccnc(-c2cc(N(C)C)ccn2)c1.COc1ccnc(-c2cc(CO)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.Nc1ccnc(-c2cc(N)ccn2)c1.O=c1cc[nH]c(-c2cc(=O)cc[nH]2)c1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C14H18N4.C12H12N2O2.C12H12N2.C10H10N4.C10H8N2O2.C10H8N2/c1-17(2)11-5-7-15-13(9-11)14-10-12(18(3)4)6-8-16-14;1-16-10-3-5-14-12(7-10)11-6-9(8-15)2-4-13-11;1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;11-7-1-3-13-9(5-7)10-6-8(12)2-4-14-10;13-7-1-3-11-9(5-7)10-6-8(14)2-4-12-10;1-3-7-11-9(5-1)10-6-2-4-8-12-10/h5-10H,1-4H3;2-7,15H,8H2,1H3;3-8H,1-2H3;1-6H,(H2,11,13)(H2,12,14);1-6H,(H,11,13)(H,12,14);1-8H
InChIKeyGKVLQHQWLZJVMM-UHFFFAOYSA-N
MW1173.40 g/mol
LogP10.86
Rot. Bonds10

About 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine

2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine (PubChem CID 158286473) has the molecular formula C68H68N16O4 and a molecular weight of 1173.40 g/mol. Its IUPAC name is 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine.

Molecular Properties

Compound Name2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine
PubChem CID158286473
Molecular FormulaC68H68N16O4
Molecular Weight1173.40 g/mol
Exact Mass1172.56
IUPAC Name2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine
SMILESCN(C)c1ccnc(-c2cc(N(C)C)ccn2)c1.COc1ccnc(-c2cc(CO)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.Nc1ccnc(-c2cc(N)ccn2)c1.O=c1cc[nH]c(-c2cc(=O)cc[nH]2)c1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C14H18N4.C12H12N2O2.C12H12N2.C10H10N4.C10H8N2O2.C10H8N2/c1-17(2)11-5-7-15-13(9-11)14-10-12(18(3)4)6-8-16-14;1-16-10-3-5-14-12(7-10)11-6-9(8-15)2-4-13-11;1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;11-7-1-3-13-9(5-7)10-6-8(12)2-4-14-10;13-7-1-3-11-9(5-7)10-6-8(14)2-4-12-10;1-3-7-11-9(5-1)10-6-2-4-8-12-10/h5-10H,1-4H3;2-7,15H,8H2,1H3;3-8H,1-2H3;1-6H,(H2,11,13)(H2,12,14);1-6H,(H,11,13)(H,12,14);1-8H
InChIKeyGKVLQHQWLZJVMM-UHFFFAOYSA-N
XLogP10.86
TPSA282.60 Ų
H-Bond Donors5
H-Bond Acceptors18
Rotatable Bonds10
Heavy Atoms88
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001173.40
LogP ≤ 510.86
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1018

Analyze 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine?
The IUPAC name of 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine (CID 158286473) is 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine.
What is the SMILES notation for 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine?
The canonical SMILES for 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine is CN(C)c1ccnc(-c2cc(N(C)C)ccn2)c1.COc1ccnc(-c2cc(CO)ccn2)c1.Cc1ccnc(-c2cc(C)ccn2)c1.Nc1ccnc(-c2cc(N)ccn2)c1.O=c1cc[nH]c(-c2cc(=O)cc[nH]2)c1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine?
The InChIKey is GKVLQHQWLZJVMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4.C12H12N2O2.C12H12N2.C10H10N4.C10H8N2O2.C10H8N2/c1-17(2)11-5-7-15-13(9-11)14-10-12(18(3)4)6-8-16-14;1-16-10-3-5-14-12(7-10)11-6-9(8-15)2-4-13-11;1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;11-7-1-3-13-9(5-7)10-6-8(12)2-4-14-10;13-7-1-3-11-9(5-7)10-6-8(14)2-4-12-10;1-3-7-11-9(5-1)10-6-2-4-8-12-10/h5-10H,1-4H3;2-7,15H,8H2,1H3;3-8H,1-2H3;1-6H,(H2,11,13)(H2,12,14);1-6H,(H,11,13)(H,12,14);1-8H.
What are the key properties of 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine?
2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine has a molecular weight of 1173.40 g/mol, XLogP of 10.86, 10 rotatable bonds, 5 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2-pyridinyl)pyridin-4-amine;2-[4-(dimethylamino)-2-pyridinyl]-N,N-dimethylpyridin-4-amine;[2-(4-methoxy-2-pyridinyl)-4-pyridinyl]methanol;4-methyl-2-(4-methyl-2-pyridinyl)pyridine;2-(4-oxo-1H-pyridin-2-yl)-1H-pyridin-4-one;2-pyridin-2-ylpyridine is sourced from PubChem (CID 158286473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).