4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide

C13H24N2O2 — CID 115150764

IUPAC4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide
SMILESCN1CCCC(NC(=O)C2CCC(O)CC2)C1
InChIInChI=1S/C13H24N2O2/c1-15-8-2-3-11(9-15)14-13(17)10-4-6-12(16)7-5-10/h10-12,16H,2-9H2,1H3,(H,14,17)
InChIKeyLKKKGDVMQHUOMR-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.75
Rot. Bonds2

About 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide

4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide (PubChem CID 115150764) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide
PubChem CID115150764
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide
SMILESCN1CCCC(NC(=O)C2CCC(O)CC2)C1
InChIInChI=1S/C13H24N2O2/c1-15-8-2-3-11(9-15)14-13(17)10-4-6-12(16)7-5-10/h10-12,16H,2-9H2,1H3,(H,14,17)
InChIKeyLKKKGDVMQHUOMR-UHFFFAOYSA-N
XLogP0.75
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-hydroxyethyl)-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide
CID 115150990
3-[(1-methylpiperidin-3-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63783132
(3R)-N-cyclohexyl-1-methylpiperidine-3-carboxamide
CID 95183728
4-(methylamino)-N-(1-methylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 115150628
[(3R)-1-methylpiperidin-3-yl]carbamic acid
CID 175691082
[(3S)-1-methylpiperidin-3-yl]carbamic acid
CID 172824480
4-hydroxy-N-(1-methylpiperidin-3-yl)pyrrolidine-2-carboxamide
CID 61212180
N-(1-methylpyrrolidin-3-yl)piperidine-4-carboxamide
CID 61465348
3-amino-N-(1-methylpyrrolidin-3-yl)cyclopentane-1-carboxamide
CID 66007963
N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]cyclopentanecarboxamide
CID 45181380
4-[[(1-methylpiperidin-3-yl)amino]methyl]cyclohexan-1-ol
CID 106126243
N-[(3S)-1-methylpiperidin-3-yl]prop-2-enamide
CID 118137431

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide (CID 115150764) is 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide is CN1CCCC(NC(=O)C2CCC(O)CC2)C1.
What is the InChIKey of 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide?
The InChIKey is LKKKGDVMQHUOMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-15-8-2-3-11(9-15)14-13(17)10-4-6-12(16)7-5-10/h10-12,16H,2-9H2,1H3,(H,14,17).
What are the key properties of 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide?
4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(1-methylpiperidin-3-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 115150764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).