2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid

C12H20N2O3 — CID 64702597

IUPAC2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid
SMILESCN(C(=O)NC1(CC(=O)O)CCCC1)C1CC1
InChIInChI=1S/C12H20N2O3/c1-14(9-4-5-9)11(17)13-12(8-10(15)16)6-2-3-7-12/h9H,2-8H2,1H3,(H,13,17)(H,15,16)
InChIKeyWWGWTQBUGPHQBH-UHFFFAOYSA-N
MW240.30 g/mol
LogP1.58
Rot. Bonds4

About 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid

2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid (PubChem CID 64702597) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid
PubChem CID64702597
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid
SMILESCN(C(=O)NC1(CC(=O)O)CCCC1)C1CC1
InChIInChI=1S/C12H20N2O3/c1-14(9-4-5-9)11(17)13-12(8-10(15)16)6-2-3-7-12/h9H,2-8H2,1H3,(H,13,17)(H,15,16)
InChIKeyWWGWTQBUGPHQBH-UHFFFAOYSA-N
XLogP1.58
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[[cyclohexyl(methyl)carbamoyl]amino]cyclobutyl]acetic acid
CID 79846087
2-[1-[[methyl(oxan-4-ylmethyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64699572
2-[1-[[methyl(2,2,2-trifluoroethyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64700073
2-[1-(diethylcarbamoylamino)cyclopentyl]acetic acid
CID 64701206
2-[1-[[2-cyanoethyl(cyclopropyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64701274
2-[1-[[[2-(dimethylamino)-2-oxoethyl]-methylcarbamoyl]amino]cyclobutyl]acetic acid
CID 79846292
2-[1-(dipropylcarbamoylamino)cyclopentyl]acetic acid
CID 64702576
2-[1-[[cyclobutyl(2-hydroxyethyl)carbamoyl]amino]cyclobutyl]acetic acid
CID 102865457
2-[1-[[2-methoxypropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 112754573
2-[1-(dipropylcarbamoylamino)cyclohexyl]acetic acid
CID 64702575
2-[1-[[(3-methoxy-2-methyl-3-oxopropyl)-methylcarbamoyl]amino]cyclopentyl]acetic acid
CID 64700888
2-[1-[[ethyl(propyl)carbamoyl]amino]cyclopentyl]acetic acid
CID 64700256

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid (CID 64702597) is 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid is CN(C(=O)NC1(CC(=O)O)CCCC1)C1CC1.
What is the InChIKey of 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid?
The InChIKey is WWGWTQBUGPHQBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-14(9-4-5-9)11(17)13-12(8-10(15)16)6-2-3-7-12/h9H,2-8H2,1H3,(H,13,17)(H,15,16).
What are the key properties of 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid?
2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid has a molecular weight of 240.30 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64702597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).