6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide

C14H23N3O — CID 62073113

IUPAC6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide
SMILESCC(C)CCCC(C)NC(=O)c1ccc(N)nc1
InChIInChI=1S/C14H23N3O/c1-10(2)5-4-6-11(3)17-14(18)12-7-8-13(15)16-9-12/h7-11H,4-6H2,1-3H3,(H2,15,16)(H,17,18)
InChIKeyQPSAUQDLKZLKMM-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.61
Rot. Bonds6

About 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide

6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide (PubChem CID 62073113) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide
PubChem CID62073113
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide
SMILESCC(C)CCCC(C)NC(=O)c1ccc(N)nc1
InChIInChI=1S/C14H23N3O/c1-10(2)5-4-6-11(3)17-14(18)12-7-8-13(15)16-9-12/h7-11H,4-6H2,1-3H3,(H2,15,16)(H,17,18)
InChIKeyQPSAUQDLKZLKMM-UHFFFAOYSA-N
XLogP2.61
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-butan-2-ylpyridine-3-carboxamide
CID 62072773
6-amino-N-[5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 62153221
5-(6-methylheptan-2-ylcarbamoyl)pyridine-2-carboxylic acid
CID 60725401
6-amino-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 62072779
6-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-3-carboxamide
CID 63009864
6-amino-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-3-carboxamide
CID 55041432
N-(6-methylheptan-2-yl)-4-sulfanylbenzamide
CID 107025136
N-(6-methylheptan-2-yl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 46515997
3-amino-4-fluoro-N-(6-methylheptan-2-yl)benzamide
CID 61111337
6-amino-N-[(2S)-1-hydroxybutan-2-yl]pyridine-3-carboxamide
CID 124514500
5-[(6-methylpyridine-3-carbonyl)amino]hexanoic acid
CID 82855069
4-amino-N-(6-methylheptan-2-yl)pyridine-2-carboxamide
CID 55041915

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide (CID 62073113) is 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide is CC(C)CCCC(C)NC(=O)c1ccc(N)nc1.
What is the InChIKey of 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide?
The InChIKey is QPSAUQDLKZLKMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-10(2)5-4-6-11(3)17-14(18)12-7-8-13(15)16-9-12/h7-11H,4-6H2,1-3H3,(H2,15,16)(H,17,18).
What are the key properties of 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide?
6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide has a molecular weight of 249.36 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(6-methylheptan-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 62073113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).