2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid

C11H18N2O3 — CID 64815725

IUPAC2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
SMILESCN(C(=O)NC1CCCC1C(=O)O)C1CC1
InChIInChI=1S/C11H18N2O3/c1-13(7-5-6-7)11(16)12-9-4-2-3-8(9)10(14)15/h7-9H,2-6H2,1H3,(H,12,16)(H,14,15)
InChIKeyKVPJYKUSGXXTIT-UHFFFAOYSA-N
MW226.28 g/mol
LogP1.04
Rot. Bonds3

About 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid

2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 64815725) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
PubChem CID64815725
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
SMILESCN(C(=O)NC1CCCC1C(=O)O)C1CC1
InChIInChI=1S/C11H18N2O3/c1-13(7-5-6-7)11(16)12-9-4-2-3-8(9)10(14)15/h7-9H,2-6H2,1H3,(H,12,16)(H,14,15)
InChIKeyKVPJYKUSGXXTIT-UHFFFAOYSA-N
XLogP1.04
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cyclopentyl(methyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64816118
2-[[methyl(oxolan-3-yl)carbamoyl]amino]cycloheptane-1-carboxylic acid
CID 82742597
2-[[cyclopropyl(2-hydroxyethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 64815568
2-[[(2-methoxy-2-oxoethyl)-methylcarbamoyl]amino]cyclopentane-1-carboxylic acid
CID 64815512
2-[[cyclopropyl(propyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64816508
cis-(1R,3S)-3-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 106319286
2-[[cyclopentyl(2-hydroxyethyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64816348
2-[[butyl(cyclopropyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64818273
2-[(2-methylcyclopentanecarbonyl)amino]cyclohexane-1-carboxylic acid
CID 107175594
2-[[(3-methoxy-3-oxopropyl)-methylcarbamoyl]amino]cyclopentane-1-carboxylic acid
CID 64816735
2-[[methyl(2-methylsulfonylethyl)carbamoyl]amino]cyclopentane-1-carboxylic acid
CID 79864609
trans-(1R,2R)-2-(methoxycarbonylamino)cyclopentane-1-carboxylic acid
CID 59166337

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid (CID 64815725) is 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid is CN(C(=O)NC1CCCC1C(=O)O)C1CC1.
What is the InChIKey of 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is KVPJYKUSGXXTIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c1-13(7-5-6-7)11(16)12-9-4-2-3-8(9)10(14)15/h7-9H,2-6H2,1H3,(H,12,16)(H,14,15).
What are the key properties of 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid?
2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 226.28 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclopropyl(methyl)carbamoyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 64815725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).