N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide

C15H23N3O — CID 44761338

IUPACN-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1ncccc1C(=O)NC1CCCCC1
InChIInChI=1S/C15H23N3O/c1-11(2)17-14-13(9-6-10-16-14)15(19)18-12-7-4-3-5-8-12/h6,9-12H,3-5,7-8H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyXZQOIYHRLFVRTA-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.96
Rot. Bonds4

About N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide

N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide (PubChem CID 44761338) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
PubChem CID44761338
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1ncccc1C(=O)NC1CCCCC1
InChIInChI=1S/C15H23N3O/c1-11(2)17-14-13(9-6-10-16-14)15(19)18-12-7-4-3-5-8-12/h6,9-12H,3-5,7-8H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyXZQOIYHRLFVRTA-UHFFFAOYSA-N
XLogP2.96
TPSA54.02 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 ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpiperidin-4-yl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 120602068
2-(propan-2-ylamino)-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide
CID 154746519
2-(propan-2-ylamino)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyridine-3-carboxamide
CID 95780447
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017
N-cycloheptyl-2-(propan-2-ylamino)benzamide
CID 63107657
N-(2-methylpiperidin-3-yl)-2-(propan-2-ylamino)pyridine-3-carboxamide;dihydrochloride
CID 120576232
methyl 2-(1-cyclohexylethylamino)pyridine-3-carboxylate
CID 62407549
N-(1-cyclohexylethyl)-2-(methylamino)pyridine-3-carboxamide
CID 62405131
N-[(2-hydroxycyclopentyl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 111540624
2-(cyclopropylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 84574880
N-(1,1-dioxothian-3-yl)-2-(methylamino)pyridine-3-carboxamide
CID 63918472
N-(4-hydroxyphenyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 84574934

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide (CID 44761338) is N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide is CC(C)Nc1ncccc1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide?
The InChIKey is XZQOIYHRLFVRTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)17-14-13(9-6-10-16-14)15(19)18-12-7-4-3-5-8-12/h6,9-12H,3-5,7-8H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide?
N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 44761338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).