N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide

C13H24N2O2 — CID 55179480

IUPACN-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)NC2CCCC(O)C2)CCNCC1
InChIInChI=1S/C13H24N2O2/c1-13(5-7-14-8-6-13)12(17)15-10-3-2-4-11(16)9-10/h10-11,14,16H,2-9H2,1H3,(H,15,17)
InChIKeyRBIGKZDMAVVGLL-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.80
Rot. Bonds2

About N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide

N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide (PubChem CID 55179480) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide
PubChem CID55179480
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)NC2CCCC(O)C2)CCNCC1
InChIInChI=1S/C13H24N2O2/c1-13(5-7-14-8-6-13)12(17)15-10-3-2-4-11(16)9-10/h10-11,14,16H,2-9H2,1H3,(H,15,17)
InChIKeyRBIGKZDMAVVGLL-UHFFFAOYSA-N
XLogP0.80
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide?
The IUPAC name of N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide (CID 55179480) is N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide is CC1(C(=O)NC2CCCC(O)C2)CCNCC1.
What is the InChIKey of N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide?
The InChIKey is RBIGKZDMAVVGLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-13(5-7-14-8-6-13)12(17)15-10-3-2-4-11(16)9-10/h10-11,14,16H,2-9H2,1H3,(H,15,17).
What are the key properties of N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide?
N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.80, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclohexyl)-4-methylpiperidine-4-carboxamide is sourced from PubChem (CID 55179480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).