2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid

C11H18N2O3 — CID 61187386

IUPAC2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)NC1CCCC1)C1CC1
InChIInChI=1S/C11H18N2O3/c14-10(15)7-13(9-5-6-9)11(16)12-8-3-1-2-4-8/h8-9H,1-7H2,(H,12,16)(H,14,15)
InChIKeyROWFWKBYERVZBU-UHFFFAOYSA-N
MW226.28 g/mol
LogP1.19
Rot. Bonds4

About 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid

2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid (PubChem CID 61187386) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid
PubChem CID61187386
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)NC1CCCC1)C1CC1
InChIInChI=1S/C11H18N2O3/c14-10(15)7-13(9-5-6-9)11(16)12-8-3-1-2-4-8/h8-9H,1-7H2,(H,12,16)(H,14,15)
InChIKeyROWFWKBYERVZBU-UHFFFAOYSA-N
XLogP1.19
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclopentyl(oxan-4-ylcarbamoyl)amino]acetic acid
CID 61202948
3-[cyclooctylcarbamoyl(cyclopropyl)amino]propanoic acid
CID 61181431
2-[[2-(cyclohexylamino)-2-oxoethyl]-cyclopropylamino]acetic acid
CID 54945026
2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid
CID 64669041
2-[(2-amino-2-oxoethyl)-(cyclooctylcarbamoyl)amino]acetic acid
CID 107437429
2-[cyclopentyl(2-methylbutan-2-ylcarbamoyl)amino]acetic acid
CID 61188941
2-[butan-2-yl(cyclohexylcarbamoyl)amino]acetic acid
CID 60828429
ethyl 2-[cyclopropyl(cyclopropylcarbamoyl)amino]acetate
CID 62698175
3-cyclobutyl-1-cyclopentyl-1-(3-methylbutyl)urea
CID 115642218
1-(3-aminopropyl)-1-cyclobutyl-3-cyclohexylurea
CID 102874242
2-[cyclopropyl(propylcarbamoyl)amino]acetic acid
CID 60828450
2-[cycloheptylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79271342

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid (CID 61187386) is 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid is O=C(O)CN(C(=O)NC1CCCC1)C1CC1.
What is the InChIKey of 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid?
The InChIKey is ROWFWKBYERVZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c14-10(15)7-13(9-5-6-9)11(16)12-8-3-1-2-4-8/h8-9H,1-7H2,(H,12,16)(H,14,15).
What are the key properties of 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid?
2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid has a molecular weight of 226.28 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentylcarbamoyl(cyclopropyl)amino]acetic acid is sourced from PubChem (CID 61187386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).