4-(hydroxymethyl)piperidine-1-carboxamide

C7H14N2O2 — CID 54594894

IUPAC4-(hydroxymethyl)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(CO)CC1
InChIInChI=1S/C7H14N2O2/c8-7(11)9-3-1-6(5-10)2-4-9/h6,10H,1-5H2,(H2,8,11)
InChIKeySHTIUFVGSVRXIQ-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.23
Rot. Bonds1

About 4-(hydroxymethyl)piperidine-1-carboxamide

4-(hydroxymethyl)piperidine-1-carboxamide (PubChem CID 54594894) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 4-(hydroxymethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(hydroxymethyl)piperidine-1-carboxamide
PubChem CID54594894
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name4-(hydroxymethyl)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(CO)CC1
InChIInChI=1S/C7H14N2O2/c8-7(11)9-3-1-6(5-10)2-4-9/h6,10H,1-5H2,(H2,8,11)
InChIKeySHTIUFVGSVRXIQ-UHFFFAOYSA-N
XLogP-0.23
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)piperidine-1-carboxamide?
The IUPAC name of 4-(hydroxymethyl)piperidine-1-carboxamide (CID 54594894) is 4-(hydroxymethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(hydroxymethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(hydroxymethyl)piperidine-1-carboxamide is NC(=O)N1CCC(CO)CC1.
What is the InChIKey of 4-(hydroxymethyl)piperidine-1-carboxamide?
The InChIKey is SHTIUFVGSVRXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c8-7(11)9-3-1-6(5-10)2-4-9/h6,10H,1-5H2,(H2,8,11).
What are the key properties of 4-(hydroxymethyl)piperidine-1-carboxamide?
4-(hydroxymethyl)piperidine-1-carboxamide has a molecular weight of 158.20 g/mol, XLogP of -0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)piperidine-1-carboxamide is sourced from PubChem (CID 54594894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).