N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide

C15H23N3O — CID 63939735

IUPACN-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)N(CC)CC2CC2)c1
InChIInChI=1S/C15H23N3O/c1-3-8-16-13-7-9-17-14(10-13)15(19)18(4-2)11-12-5-6-12/h7,9-10,12H,3-6,8,11H2,1-2H3,(H,16,17)
InChIKeyNMVWBECXNVDETF-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.78
Rot. Bonds7

About N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide

N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide (PubChem CID 63939735) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide
PubChem CID63939735
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)N(CC)CC2CC2)c1
InChIInChI=1S/C15H23N3O/c1-3-8-16-13-7-9-17-14(10-13)15(19)18(4-2)11-12-5-6-12/h7,9-10,12H,3-6,8,11H2,1-2H3,(H,16,17)
InChIKeyNMVWBECXNVDETF-UHFFFAOYSA-N
XLogP2.78
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-4-(propylamino)pyridine-2-carboxamide
CID 43395263
N-ethyl-N-(2-hydroxy-2-methylpropyl)-4-(propylamino)pyridine-2-carboxamide
CID 79386430
N-(cyclopropylmethyl)-N-ethyl-6-(propylamino)pyridine-2-carboxamide
CID 63938951
N-(4-ethylcyclohexyl)-4-(propylamino)pyridine-2-carboxamide
CID 63498977
N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
CID 63940110
N-ethyl-4-(ethylamino)-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 62179440
N-(cyclohexylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62169677
N,N-diethyl-4-(2,2,2-trifluoroethylamino)pyridine-2-carboxamide
CID 43517418
N-methyl-N-(2-methylcyclohexyl)-4-(propylamino)pyridine-2-carboxamide
CID 62175380
N,N-diethyl-4-[(4-methylcyclohexyl)amino]pyridine-2-carboxamide
CID 43395286
N,N-diethyl-4-(oxan-3-ylmethylamino)pyridine-2-carboxamide
CID 61019704
N,N-diethyl-4-(pent-4-ynylamino)pyridine-2-carboxamide
CID 106222471

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide (CID 63939735) is N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide is CCCNc1ccnc(C(=O)N(CC)CC2CC2)c1.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide?
The InChIKey is NMVWBECXNVDETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-8-16-13-7-9-17-14(10-13)15(19)18(4-2)11-12-5-6-12/h7,9-10,12H,3-6,8,11H2,1-2H3,(H,16,17).
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide?
N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.78, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 63939735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).