3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide

C15H23N3O — CID 105070285

IUPAC3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
SMILESCC1CCCC(CCNC(=O)c2ccncc2N)C1
InChIInChI=1S/C15H23N3O/c1-11-3-2-4-12(9-11)5-8-18-15(19)13-6-7-17-10-14(13)16/h6-7,10-12H,2-5,8-9,16H2,1H3,(H,18,19)
InChIKeyCLJGBHQBWMKXGH-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.61
Rot. Bonds4

About 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide

3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide (PubChem CID 105070285) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
PubChem CID105070285
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
SMILESCC1CCCC(CCNC(=O)c2ccncc2N)C1
InChIInChI=1S/C15H23N3O/c1-11-3-2-4-12(9-11)5-8-18-15(19)13-6-7-17-10-14(13)16/h6-7,10-12H,2-5,8-9,16H2,1H3,(H,18,19)
InChIKeyCLJGBHQBWMKXGH-UHFFFAOYSA-N
XLogP2.61
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylamino)-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
CID 105070287
3-fluoro-2-hydrazinyl-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
CID 105388388
4-[2-(3-methylcyclohexyl)ethylamino]pyridine-3-carboxamide
CID 133471325
N-(2-cyclobutylethyl)-3-hydrazinylpyridine-4-carboxamide
CID 105072473
2,5-dichloro-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide
CID 114918549
3-amino-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
CID 107420601
3-amino-N-[2-(3-methylcyclohexyl)ethyl]benzamide;hydrochloride
CID 119783133
4-amino-N-(2-cyclopentylethyl)-6-methylpyridine-3-carboxamide
CID 81243330
3-amino-N-pentylpyridine-4-carboxamide
CID 105067833
3-amino-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 110849614
2-methyl-1-[2-(3-methylcyclohexyl)ethyl]-3-[2-(3-methyl-4-pyridinyl)ethyl]guanidine
CID 109403656
N-[2-[methyl-[2-(3-methylcyclohexyl)ethyl]amino]ethyl]isoquinoline-7-carboxamide
CID 166370631

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide (CID 105070285) is 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide is CC1CCCC(CCNC(=O)c2ccncc2N)C1.
What is the InChIKey of 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide?
The InChIKey is CLJGBHQBWMKXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-3-2-4-12(9-11)5-8-18-15(19)13-6-7-17-10-14(13)16/h6-7,10-12H,2-5,8-9,16H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide?
3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(3-methylcyclohexyl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 105070285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).