N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide

C12H21N3O3 — CID 100700120

IUPACN-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide
SMILESO=C1NCCN1C(=O)NC[C@@H](O)C1CCCCC1
InChIInChI=1S/C12H21N3O3/c16-10(9-4-2-1-3-5-9)8-14-12(18)15-7-6-13-11(15)17/h9-10,16H,1-8H2,(H,13,17)(H,14,18)/t10-/m1/s1
InChIKeyWZTUXWMWDPZSEI-SNVBAGLBSA-N
MW255.32 g/mol
LogP0.66
Rot. Bonds3

About N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide

N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide (PubChem CID 100700120) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide
PubChem CID100700120
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC NameN-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide
SMILESO=C1NCCN1C(=O)NC[C@@H](O)C1CCCCC1
InChIInChI=1S/C12H21N3O3/c16-10(9-4-2-1-3-5-9)8-14-12(18)15-7-6-13-11(15)17/h9-10,16H,1-8H2,(H,13,17)(H,14,18)/t10-/m1/s1
InChIKeyWZTUXWMWDPZSEI-SNVBAGLBSA-N
XLogP0.66
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclohexyl-2-hydroxyethyl)pyrrolidine-3-carboxamide
CID 119731741
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CID 100699848
N-[2-hydroxy-2-(4-methylsulfanylphenyl)ethyl]-2-oxoimidazolidine-1-carboxamide
CID 71803847
1-cyclohexyl-3-(2-cyclopropyl-2-hydroxyethyl)urea
CID 63237441
N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide
CID 95292122
(2R)-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-(2-oxopyrrolidin-1-yl)butanamide
CID 97025142
N-(2-cyclohexyl-2-hydroxyethyl)-2-(4-fluorophenyl)sulfanylacetamide
CID 71782115
N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
CID 111426324
(3R)-1-cycloheptyl-N-[(2S)-2-cyclopentyl-2-hydroxyethyl]-5-oxopyrrolidine-3-carboxamide
CID 99774273
N-(2-cyclopentyl-2-hydroxyethyl)-N'-cyclopropyloxamide
CID 111425530
3-amino-N-(2-cyclohexyl-2-hydroxyethyl)propanamide;hydrochloride
CID 119293866
N-(2-cyclopentyl-2-hydroxyethyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 111426294

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide (CID 100700120) is N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide is O=C1NCCN1C(=O)NC[C@@H](O)C1CCCCC1.
What is the InChIKey of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide?
The InChIKey is WZTUXWMWDPZSEI-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H21N3O3/c16-10(9-4-2-1-3-5-9)8-14-12(18)15-7-6-13-11(15)17/h9-10,16H,1-8H2,(H,13,17)(H,14,18)/t10-/m1/s1.
What are the key properties of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide?
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 0.66, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-2-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 100700120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).