3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide

C13H24N2O2 — CID 110896538

IUPAC3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide
SMILESCC1CCCC(NC(=O)N2CCCC(O)C2)C1
InChIInChI=1S/C13H24N2O2/c1-10-4-2-5-11(8-10)14-13(17)15-7-3-6-12(16)9-15/h10-12,16H,2-9H2,1H3,(H,14,17)
InChIKeyZAAKLVUIMRWDHT-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.73
Rot. Bonds1

About 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide

3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide (PubChem CID 110896538) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide
PubChem CID110896538
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide
SMILESCC1CCCC(NC(=O)N2CCCC(O)C2)C1
InChIInChI=1S/C13H24N2O2/c1-10-4-2-5-11(8-10)14-13(17)15-7-3-6-12(16)9-15/h10-12,16H,2-9H2,1H3,(H,14,17)
InChIKeyZAAKLVUIMRWDHT-UHFFFAOYSA-N
XLogP1.73
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide?
The IUPAC name of 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide (CID 110896538) is 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide?
The canonical SMILES for 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide is CC1CCCC(NC(=O)N2CCCC(O)C2)C1.
What is the InChIKey of 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide?
The InChIKey is ZAAKLVUIMRWDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10-4-2-5-11(8-10)14-13(17)15-7-3-6-12(16)9-15/h10-12,16H,2-9H2,1H3,(H,14,17).
What are the key properties of 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide?
3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 1.73, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(3-methylcyclohexyl)piperidine-1-carboxamide is sourced from PubChem (CID 110896538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).