3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide

C15H24N4O — CID 104740859

IUPAC3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide
SMILESCC1CCCCN1CCCNC(=O)c1ncccc1N
InChIInChI=1S/C15H24N4O/c1-12-6-2-3-10-19(12)11-5-9-18-15(20)14-13(16)7-4-8-17-14/h4,7-8,12H,2-3,5-6,9-11,16H2,1H3,(H,18,20)
InChIKeyIHPZZUKRLGMULC-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.66
Rot. Bonds5

About 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide

3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide (PubChem CID 104740859) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide
PubChem CID104740859
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide
SMILESCC1CCCCN1CCCNC(=O)c1ncccc1N
InChIInChI=1S/C15H24N4O/c1-12-6-2-3-10-19(12)11-5-9-18-15(20)14-13(16)7-4-8-17-14/h4,7-8,12H,2-3,5-6,9-11,16H2,1H3,(H,18,20)
InChIKeyIHPZZUKRLGMULC-UHFFFAOYSA-N
XLogP1.66
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyrazine-2-carboxamide
CID 47140611
2-amino-N-[4-(2-methylpiperidin-1-yl)butyl]benzamide
CID 119946610
2-methoxy-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
CID 134003012
4-amino-N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]benzamide
CID 38989093
N-[3-(2-methylpiperidin-1-yl)propyl]benzamide
CID 60668475
6-hydrazinyl-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
CID 62237824
3-amino-N-[(1-methylpiperidin-2-yl)methyl]pyridine-2-carboxamide
CID 113447691
3,6-dichloro-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide
CID 43080560
N-[3-[(2R)-2-methylpiperidin-1-yl]propyl]-1H-pyrazole-5-carboxamide
CID 95281410
N-[3-[(2S)-2-methylpiperidin-1-yl]propyl]-4-pyrazol-1-ylbenzamide
CID 9473184
(2S)-2-amino-N-[3-(2-methylpiperidin-1-yl)propyl]-2-phenylacetamide
CID 104897103
2-amino-N-[3-(2-methylpiperidin-1-yl)propyl]-1,3-thiazole-4-carboxamide
CID 62794675

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide (CID 104740859) is 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide is CC1CCCCN1CCCNC(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide?
The InChIKey is IHPZZUKRLGMULC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-12-6-2-3-10-19(12)11-5-9-18-15(20)14-13(16)7-4-8-17-14/h4,7-8,12H,2-3,5-6,9-11,16H2,1H3,(H,18,20).
What are the key properties of 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide?
3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-2-carboxamide is sourced from PubChem (CID 104740859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).