3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide

C10H20N2O2 — CID 43403430

IUPAC3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCCC(CO)C1
InChIInChI=1S/C10H20N2O2/c1-2-5-11-10(14)12-6-3-4-9(7-12)8-13/h9,13H,2-8H2,1H3,(H,11,14)
InChIKeyOKISVKKAMJJMKF-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.81
Rot. Bonds3

About 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide

3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide (PubChem CID 43403430) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide
PubChem CID43403430
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide
SMILESCCCNC(=O)N1CCCC(CO)C1
InChIInChI=1S/C10H20N2O2/c1-2-5-11-10(14)12-6-3-4-9(7-12)8-13/h9,13H,2-8H2,1H3,(H,11,14)
InChIKeyOKISVKKAMJJMKF-UHFFFAOYSA-N
XLogP0.81
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide?
The IUPAC name of 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide (CID 43403430) is 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide.
What is the SMILES notation for 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide?
The canonical SMILES for 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide is CCCNC(=O)N1CCCC(CO)C1.
What is the InChIKey of 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide?
The InChIKey is OKISVKKAMJJMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-5-11-10(14)12-6-3-4-9(7-12)8-13/h9,13H,2-8H2,1H3,(H,11,14).
What are the key properties of 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide?
3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(hydroxymethyl)-N-propylpiperidine-1-carboxamide is sourced from PubChem (CID 43403430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).