2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide

C17H28N4O — CID 95388316

IUPAC2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide
SMILESCC(C)CN1CCC[C@H](CCNC(=O)c2ccnc(N)c2)C1
InChIInChI=1S/C17H28N4O/c1-13(2)11-21-9-3-4-14(12-21)5-7-20-17(22)15-6-8-19-16(18)10-15/h6,8,10,13-14H,3-5,7,9,11-12H2,1-2H3,(H2,18,19)(H,20,22)/t14-/m1/s1
InChIKeyVIHBRUXQXSWGQZ-CQSZACIVSA-N
MW304.44 g/mol
LogP2.15
Rot. Bonds6

About 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide

2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide (PubChem CID 95388316) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide
PubChem CID95388316
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC Name2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide
SMILESCC(C)CN1CCC[C@H](CCNC(=O)c2ccnc(N)c2)C1
InChIInChI=1S/C17H28N4O/c1-13(2)11-21-9-3-4-14(12-21)5-7-20-17(22)15-6-8-19-16(18)10-15/h6,8,10,13-14H,3-5,7,9,11-12H2,1-2H3,(H2,18,19)(H,20,22)/t14-/m1/s1
InChIKeyVIHBRUXQXSWGQZ-CQSZACIVSA-N
XLogP2.15
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide with MolForge

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Related Compounds

2-amino-N-(2-cyclopentylethyl)pyridine-4-carboxamide
CID 62161813
5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide
CID 56706311
2-amino-N-(2-cyclopentyloxyethyl)pyridine-4-carboxamide
CID 63834137
N-(2-cyclopentylethyl)-2-(hydroxymethyl)pyridine-4-carboxamide
CID 115116140
3-hydroxy-N-[[(3S)-1-(2-methylpropyl)piperidin-3-yl]methyl]pyridine-2-carboxamide
CID 95226078
2-amino-N-cyclopentylpyridine-4-carboxamide
CID 62154850
(2-amino-4-pyridinyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107228705
4-[1-(2-methylpropyl)piperidin-3-yl]butan-2-one
CID 83982945
3-amino-N-[2-[1-(furan-2-ylmethyl)piperidin-3-yl]ethyl]benzamide;hydrochloride
CID 154887421
N-methyl-2-[1-(2-methylpropyl)piperidin-3-yl]ethanamine
CID 83982939
2-cyano-N-(2-cyclopentylethyl)pyridine-4-carboxamide
CID 115115922
2-methoxy-N-[2-[(3S)-1-(oxan-4-yl)piperidin-3-yl]ethyl]pyridine-4-carboxamide
CID 95214166

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide (CID 95388316) is 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide is CC(C)CN1CCC[C@H](CCNC(=O)c2ccnc(N)c2)C1.
What is the InChIKey of 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide?
The InChIKey is VIHBRUXQXSWGQZ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H28N4O/c1-13(2)11-21-9-3-4-14(12-21)5-7-20-17(22)15-6-8-19-16(18)10-15/h6,8,10,13-14H,3-5,7,9,11-12H2,1-2H3,(H2,18,19)(H,20,22)/t14-/m1/s1.
What are the key properties of 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide?
2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide has a molecular weight of 304.44 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 95388316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).