N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide

C12H19N3O — CID 62240109

IUPACN-propan-2-yl-6-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1cccc(C(=O)NC(C)C)n1
InChIInChI=1S/C12H19N3O/c1-4-8-13-11-7-5-6-10(15-11)12(16)14-9(2)3/h5-7,9H,4,8H2,1-3H3,(H,13,15)(H,14,16)
InChIKeyLQPZBYBMWRRXRQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.04
Rot. Bonds5

About N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide

N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide (PubChem CID 62240109) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-6-(propylamino)pyridine-2-carboxamide
PubChem CID62240109
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-propan-2-yl-6-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1cccc(C(=O)NC(C)C)n1
InChIInChI=1S/C12H19N3O/c1-4-8-13-11-7-5-6-10(15-11)12(16)14-9(2)3/h5-7,9H,4,8H2,1-3H3,(H,13,15)(H,14,16)
InChIKeyLQPZBYBMWRRXRQ-UHFFFAOYSA-N
XLogP2.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide
CID 62241135
N-(6-methylheptan-2-yl)-6-(propylamino)pyridine-2-carboxamide
CID 63499181
N-octan-4-yl-6-(propylamino)pyridine-2-carboxamide
CID 106027806
N-(3-methyl-2-propan-2-ylbutyl)-6-(propylamino)pyridine-2-carboxamide
CID 102907982
N-(4-propan-2-yl-1,3-thiazol-2-yl)-6-(propylamino)pyridine-2-carboxamide
CID 62239162
N-[2-(ethylamino)-2-oxoethyl]-6-(propylamino)pyridine-2-carboxamide
CID 55052141
N-methyl-N-pentan-2-yl-6-(propylamino)pyridine-2-carboxamide
CID 55052478
N-methyl-N-(4-methylpentan-2-yl)-6-(propylamino)pyridine-2-carboxamide
CID 62238841
N-(4-iodophenyl)-6-(propylamino)pyridine-2-carboxamide
CID 63499138
6-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-2-carboxamide
CID 64604327
N-(2-methylphenyl)-6-(propylamino)pyridine-2-carboxamide
CID 62240814
N-(2,6-dimethylpiperidin-1-yl)-6-(propylamino)pyridine-2-carboxamide
CID 83015635

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide (CID 62240109) is N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide is CCCNc1cccc(C(=O)NC(C)C)n1.
What is the InChIKey of N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide?
The InChIKey is LQPZBYBMWRRXRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-4-8-13-11-7-5-6-10(15-11)12(16)14-9(2)3/h5-7,9H,4,8H2,1-3H3,(H,13,15)(H,14,16).
What are the key properties of N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide?
N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-6-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62240109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).