N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide

C13H22N2O3 — CID 143286863

IUPACN-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide
SMILESO=C(CO)NC1CCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C13H22N2O3/c16-9-12(17)14-11-6-7-15(8-11)13(18)10-4-2-1-3-5-10/h10-11,16H,1-9H2,(H,14,17)
InChIKeyJYPNCZPIMWTTSE-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.28
Rot. Bonds3

About N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide

N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide (PubChem CID 143286863) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide
PubChem CID143286863
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC NameN-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide
SMILESO=C(CO)NC1CCN(C(=O)C2CCCCC2)C1
InChIInChI=1S/C13H22N2O3/c16-9-12(17)14-11-6-7-15(8-11)13(18)10-4-2-1-3-5-10/h10-11,16H,1-9H2,(H,14,17)
InChIKeyJYPNCZPIMWTTSE-UHFFFAOYSA-N
XLogP0.28
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119808786
N-[(3R)-1-(cyclopentanecarbonyl)pyrrolidin-3-yl]cyclopentanecarboxamide
CID 95051673
N-[1-(cyclobutanecarbonyl)pyrrolidin-3-yl]cyclopentanecarboxamide
CID 53016389
N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]propanamide
CID 110871450
N-[(3S)-1-(cyclopentanecarbonyl)pyrrolidin-3-yl]-2-(2-hydroxyphenyl)acetamide
CID 97014157
2-chloro-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]acetamide
CID 50988896
N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-methyl-3-(methylamino)propanamide
CID 119808791
1-[(3S)-1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-3-(2,2,2-trifluoroethyl)urea
CID 124588447
1-[(3R)-1-(cyclopentanecarbonyl)pyrrolidin-3-yl]-3-propan-2-ylurea
CID 95051729
N-[1-(cyclopentanecarbonyl)pyrrolidin-3-yl]-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)acetamide
CID 102559757
(2S)-2-amino-N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-3,3-dimethylbutanamide;hydrochloride
CID 119808784
cyclohexyl-[(3S)-3-(methylamino)piperidin-1-yl]methanone
CID 94475779

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide?
The IUPAC name of N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide (CID 143286863) is N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide.
What is the SMILES notation for N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide?
The canonical SMILES for N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide is O=C(CO)NC1CCN(C(=O)C2CCCCC2)C1.
What is the InChIKey of N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide?
The InChIKey is JYPNCZPIMWTTSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c16-9-12(17)14-11-6-7-15(8-11)13(18)10-4-2-1-3-5-10/h10-11,16H,1-9H2,(H,14,17).
What are the key properties of N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide?
N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide has a molecular weight of 254.33 g/mol, XLogP of 0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclohexanecarbonyl)pyrrolidin-3-yl]-2-hydroxyacetamide is sourced from PubChem (CID 143286863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).