N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide

C13H24N2O2 — CID 65106374

IUPACN-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
SMILESO=C(NCC1(O)CCCCC1)C1CCNCC1
InChIInChI=1S/C13H24N2O2/c16-12(11-4-8-14-9-5-11)15-10-13(17)6-2-1-3-7-13/h11,14,17H,1-10H2,(H,15,16)
InChIKeyAZTLASDPJNGSNW-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.80
Rot. Bonds3

About N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide

N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide (PubChem CID 65106374) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
PubChem CID65106374
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
SMILESO=C(NCC1(O)CCCCC1)C1CCNCC1
InChIInChI=1S/C13H24N2O2/c16-12(11-4-8-14-9-5-11)15-10-13(17)6-2-1-3-7-13/h11,14,17H,1-10H2,(H,15,16)
InChIKeyAZTLASDPJNGSNW-UHFFFAOYSA-N
XLogP0.80
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
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-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide (CID 65106374) is N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide is O=C(NCC1(O)CCCCC1)C1CCNCC1.
What is the InChIKey of N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
The InChIKey is AZTLASDPJNGSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c16-12(11-4-8-14-9-5-11)15-10-13(17)6-2-1-3-7-13/h11,14,17H,1-10H2,(H,15,16).
What are the key properties of N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.80, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 65106374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).