(2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide

C11H22N2O2 — CID 103810229

IUPAC(2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide
SMILESCCC(O)CCNC(=O)[C@@H]1CCCCN1
InChIInChI=1S/C11H22N2O2/c1-2-9(14)6-8-13-11(15)10-5-3-4-7-12-10/h9-10,12,14H,2-8H2,1H3,(H,13,15)/t9?,10-/m0/s1
InChIKeyYQTDQPNHHLEVAR-AXDSSHIGSA-N
MW214.31 g/mol
LogP0.41
Rot. Bonds5

About (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide

(2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide (PubChem CID 103810229) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide
PubChem CID103810229
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name(2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide
SMILESCCC(O)CCNC(=O)[C@@H]1CCCCN1
InChIInChI=1S/C11H22N2O2/c1-2-9(14)6-8-13-11(15)10-5-3-4-7-12-10/h9-10,12,14H,2-8H2,1H3,(H,13,15)/t9?,10-/m0/s1
InChIKeyYQTDQPNHHLEVAR-AXDSSHIGSA-N
XLogP0.41
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide?
The IUPAC name of (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide (CID 103810229) is (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide?
The canonical SMILES for (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide is CCC(O)CCNC(=O)[C@@H]1CCCCN1.
What is the InChIKey of (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide?
The InChIKey is YQTDQPNHHLEVAR-AXDSSHIGSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-2-9(14)6-8-13-11(15)10-5-3-4-7-12-10/h9-10,12,14H,2-8H2,1H3,(H,13,15)/t9?,10-/m0/s1.
What are the key properties of (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide?
(2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.41, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3-hydroxypentyl)piperidine-2-carboxamide is sourced from PubChem (CID 103810229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).