(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide

C14H26N2O2 — CID 72870335

IUPAC(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide
SMILESCC1(C)CN(C(=O)NC2CCCC2)CC[C@]1(C)O
InChIInChI=1S/C14H26N2O2/c1-13(2)10-16(9-8-14(13,3)18)12(17)15-11-6-4-5-7-11/h11,18H,4-10H2,1-3H3,(H,15,17)/t14-/m0/s1
InChIKeyRGVNVUUTGQQFTE-AWEZNQCLSA-N
MW254.37 g/mol
LogP2.12
Rot. Bonds1

About (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide

(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide (PubChem CID 72870335) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide
PubChem CID72870335
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide
SMILESCC1(C)CN(C(=O)NC2CCCC2)CC[C@]1(C)O
InChIInChI=1S/C14H26N2O2/c1-13(2)10-16(9-8-14(13,3)18)12(17)15-11-6-4-5-7-11/h11,18H,4-10H2,1-3H3,(H,15,17)/t14-/m0/s1
InChIKeyRGVNVUUTGQQFTE-AWEZNQCLSA-N
XLogP2.12
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide?
The IUPAC name of (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide (CID 72870335) is (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide.
What is the SMILES notation for (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide?
The canonical SMILES for (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide is CC1(C)CN(C(=O)NC2CCCC2)CC[C@]1(C)O.
What is the InChIKey of (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide?
The InChIKey is RGVNVUUTGQQFTE-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-13(2)10-16(9-8-14(13,3)18)12(17)15-11-6-4-5-7-11/h11,18H,4-10H2,1-3H3,(H,15,17)/t14-/m0/s1.
What are the key properties of (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide?
(4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 2.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-cyclopentyl-4-hydroxy-3,3,4-trimethylpiperidine-1-carboxamide is sourced from PubChem (CID 72870335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).