(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid

C12H22N2O3 — CID 107566149

IUPAC(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid
SMILESCCC[C@@H](NC(=O)N(C)C1CCCC1)C(=O)O
InChIInChI=1S/C12H22N2O3/c1-3-6-10(11(15)16)13-12(17)14(2)9-7-4-5-8-9/h9-10H,3-8H2,1-2H3,(H,13,17)(H,15,16)/t10-/m1/s1
InChIKeyGYJRMNGBGICLSM-SNVBAGLBSA-N
MW242.32 g/mol
LogP1.82
Rot. Bonds5

About (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid

(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid (PubChem CID 107566149) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid.

Molecular Properties

Compound Name(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid
PubChem CID107566149
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC Name(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid
SMILESCCC[C@@H](NC(=O)N(C)C1CCCC1)C(=O)O
InChIInChI=1S/C12H22N2O3/c1-3-6-10(11(15)16)13-12(17)14(2)9-7-4-5-8-9/h9-10H,3-8H2,1-2H3,(H,13,17)(H,15,16)/t10-/m1/s1
InChIKeyGYJRMNGBGICLSM-SNVBAGLBSA-N
XLogP1.82
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cycloheptyl(methyl)carbamoyl]amino]pentanoic acid
CID 61201099
2-[[cyclopentyl(methyl)carbamoyl]amino]pentanedioic acid
CID 61194163
2-[[cycloheptyl(methyl)carbamoyl]amino]butanoic acid
CID 61201094
(2S)-5-amino-2-[[cyclopentyl(methyl)carbamoyl]amino]-5-oxopentanoic acid
CID 61195271
5-amino-2-[[cycloheptyl(methyl)carbamoyl]amino]-5-oxopentanoic acid
CID 61201089
(2R)-2-[[cyclohexyl(methyl)carbamoyl]amino]-4-methylsulfanylbutanoic acid
CID 104909826
(2R)-2-[[methyl-(2-methylcyclohexyl)carbamoyl]amino]pentanoic acid
CID 107566610
(2S)-2-[[cyclohexyl(methyl)carbamoyl]amino]-5-methoxy-5-oxopentanoic acid
CID 107143266
2-[[(1,1-dioxothiolan-3-yl)-methylcarbamoyl]amino]pentanoic acid
CID 61203915
2-[[cyclopropyl(ethyl)carbamoyl]amino]pentanoic acid
CID 61196558
(2R)-2-[[cyclopropyl(methyl)carbamoyl]amino]-4-methylsulfanylbutanoic acid
CID 104909881
(2R)-2-[[(4-ethylcyclohexyl)-methylcarbamoyl]amino]-4-hydroxybutanoic acid
CID 107826727

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid?
The IUPAC name of (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid (CID 107566149) is (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid.
What is the SMILES notation for (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid?
The canonical SMILES for (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid is CCC[C@@H](NC(=O)N(C)C1CCCC1)C(=O)O.
What is the InChIKey of (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid?
The InChIKey is GYJRMNGBGICLSM-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-3-6-10(11(15)16)13-12(17)14(2)9-7-4-5-8-9/h9-10H,3-8H2,1-2H3,(H,13,17)(H,15,16)/t10-/m1/s1.
What are the key properties of (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid?
(2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid has a molecular weight of 242.32 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[cyclopentyl(methyl)carbamoyl]amino]pentanoic acid is sourced from PubChem (CID 107566149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).