1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide

C18H28N4O — CID 154793823

IUPAC1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide
SMILESCN1CCCCC1C(=O)NC1CCC(Nc2ccccn2)CC1
InChIInChI=1S/C18H28N4O/c1-22-13-5-3-6-16(22)18(23)21-15-10-8-14(9-11-15)20-17-7-2-4-12-19-17/h2,4,7,12,14-16H,3,5-6,8-11,13H2,1H3,(H,19,20)(H,21,23)
InChIKeyOGSAQJFTYKTNGJ-UHFFFAOYSA-N
MW316.45 g/mol
LogP2.41
Rot. Bonds4

About 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide

1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide (PubChem CID 154793823) has the molecular formula C18H28N4O and a molecular weight of 316.45 g/mol. Its IUPAC name is 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide
PubChem CID154793823
Molecular FormulaC18H28N4O
Molecular Weight316.45 g/mol
Exact Mass316.23
IUPAC Name1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide
SMILESCN1CCCCC1C(=O)NC1CCC(Nc2ccccn2)CC1
InChIInChI=1S/C18H28N4O/c1-22-13-5-3-6-16(22)18(23)21-15-10-8-14(9-11-15)20-17-7-2-4-12-19-17/h2,4,7,12,14-16H,3,5-6,8-11,13H2,1H3,(H,19,20)(H,21,23)
InChIKeyOGSAQJFTYKTNGJ-UHFFFAOYSA-N
XLogP2.41
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(pyridin-2-ylamino)cyclohexyl]cyclopropanecarboxamide
CID 166194505
N-(1-methylpiperidin-4-yl)pyridin-2-amine;dihydrochloride
CID 174544706
N-cyclohexylpyridin-2-amine;methanamine
CID 143850003
N-cyclopropyl-1-pyridin-2-ylpyrrolidine-2-carboxamide
CID 91662065
(3R)-3-N-cyclohexyl-1-N-pyridin-2-ylpiperidine-1,3-dicarboxamide
CID 95154562
6-(azetidin-1-yl)-N-[4-(pyridin-2-ylamino)cyclohexyl]pyridine-3-carboxamide
CID 136584132
(1-methylpiperidin-2-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 110854882
(2R)-1-methyl-N-(2-pyridin-2-ylsulfanylethyl)azepane-2-carboxamide
CID 97189055
N-(4-pyrimidin-2-yloxycyclohexyl)cyclopentanecarboxamide
CID 90633226
3-[4-(pyridin-2-ylamino)piperidin-1-yl]propanoic acid
CID 134069519
N-(6-ethoxy-2-pyridinyl)-1-methylpiperidine-2-carboxamide
CID 167884113
1-propyl-N-(1-pyridin-2-ylpiperidin-4-yl)pyrrolidine-2-carboxamide
CID 86844344

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide?
The IUPAC name of 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide (CID 154793823) is 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide?
The canonical SMILES for 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide is CN1CCCCC1C(=O)NC1CCC(Nc2ccccn2)CC1.
What is the InChIKey of 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide?
The InChIKey is OGSAQJFTYKTNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O/c1-22-13-5-3-6-16(22)18(23)21-15-10-8-14(9-11-15)20-17-7-2-4-12-19-17/h2,4,7,12,14-16H,3,5-6,8-11,13H2,1H3,(H,19,20)(H,21,23).
What are the key properties of 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide?
1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide has a molecular weight of 316.45 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-(pyridin-2-ylamino)cyclohexyl]piperidine-2-carboxamide is sourced from PubChem (CID 154793823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).