N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide

C14H26N2O2 — CID 127775822

IUPACN-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
SMILESCC(C)(O)C1CCCN1C(=O)NC1CCCCC1
InChIInChI=1S/C14H26N2O2/c1-14(2,18)12-9-6-10-16(12)13(17)15-11-7-4-3-5-8-11/h11-12,18H,3-10H2,1-2H3,(H,15,17)
InChIKeyPRNJGTHNAZCVQS-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.26
Rot. Bonds2

About N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide

N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide (PubChem CID 127775822) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
PubChem CID127775822
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
SMILESCC(C)(O)C1CCCN1C(=O)NC1CCCCC1
InChIInChI=1S/C14H26N2O2/c1-14(2,18)12-9-6-10-16(12)13(17)15-11-7-4-3-5-8-11/h11-12,18H,3-10H2,1-2H3,(H,15,17)
InChIKeyPRNJGTHNAZCVQS-UHFFFAOYSA-N
XLogP2.26
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-hydroxypropan-2-yl)-N-(1-phenylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 75505537
(2S)-1-N-cyclohexyl-2-N-cyclopropylpyrrolidine-1,2-dicarboxamide
CID 1445867
(2S)-N-cyclooctyl-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111427691
(2R)-1-(cyclopentylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 78922982
N-cyclohexyl-2-methylpiperidine-1-carboxamide;ethane
CID 142002534
N-cyclopentyl-2-(methylaminomethyl)pyrrolidine-1-carboxamide
CID 115316412
N-cyclobutyl-2-methylpyrrolidine-1-carboxamide
CID 115664840
(2R)-N-cyclohexyl-2-[(cyclopentanecarbonylamino)carbamoyl]pyrrolidine-1-carboxamide
CID 94790588
N-cyclohexyl-2-ethylazepane-1-carboxamide
CID 113240213
(2R)-N-cyclohexyl-2-ethylpiperidine-1-carboxamide
CID 896060
N-cyclohexyl-2-ethylpiperidine-1-carboxamide
CID 2930684
(2R)-1-(cyclobutylcarbamoyl)piperidine-2-carboxylic acid
CID 94424057

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide (CID 127775822) is N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide is CC(C)(O)C1CCCN1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
The InChIKey is PRNJGTHNAZCVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-14(2,18)12-9-6-10-16(12)13(17)15-11-7-4-3-5-8-11/h11-12,18H,3-10H2,1-2H3,(H,15,17).
What are the key properties of N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 127775822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).