2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid

C14H24N2O3 — CID 114126135

IUPAC2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid
SMILESCCC1(CNC(=O)NC(C(=O)O)C2CC2)CCCC1
InChIInChI=1S/C14H24N2O3/c1-2-14(7-3-4-8-14)9-15-13(19)16-11(12(17)18)10-5-6-10/h10-11H,2-9H2,1H3,(H,17,18)(H2,15,16,19)
InChIKeyLANVXHNRLMKKOP-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.12
Rot. Bonds6

About 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid

2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid (PubChem CID 114126135) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid
PubChem CID114126135
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid
SMILESCCC1(CNC(=O)NC(C(=O)O)C2CC2)CCCC1
InChIInChI=1S/C14H24N2O3/c1-2-14(7-3-4-8-14)9-15-13(19)16-11(12(17)18)10-5-6-10/h10-11H,2-9H2,1H3,(H,17,18)(H2,15,16,19)
InChIKeyLANVXHNRLMKKOP-UHFFFAOYSA-N
XLogP2.12
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-2-[[1-(dimethylamino)cyclopentyl]methylcarbamoylamino]acetic acid
CID 83114452
2-cyclohexyl-2-[(1-methylcyclopropyl)methylcarbamoylamino]acetic acid
CID 113364251
2-cyclopropyl-2-[2-(dimethylamino)ethylcarbamoylamino]acetic acid
CID 62695644
2-cyclopropyl-2-[2-(dimethylamino)propylcarbamoylamino]acetic acid
CID 62711231
2-cyclopropyl-2-[(4-methylphenyl)methylcarbamoylamino]acetic acid
CID 62710013
2-cyclopropyl-2-(2-ethoxyethylcarbamoylamino)acetic acid
CID 62711213
2-cyclohexyl-2-(2-cyclopropylpropylcarbamoylamino)acetic acid
CID 103997560
2-cyclopropyl-2-[2-(diethylamino)ethylcarbamoylamino]acetic acid
CID 62710692
2-cyclopropyl-2-[(2-ethylpyrrolidine-2-carbonyl)amino]acetic acid
CID 83071456
2-cyclohexyl-2-(2-methylbutylcarbamoylamino)acetic acid
CID 55108414
2-cyclohexyl-2-[3-(methylamino)propylcarbamoylamino]acetic acid
CID 61404684
1-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-propan-2-ylurea
CID 115362818

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid?
The IUPAC name of 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid (CID 114126135) is 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid.
What is the SMILES notation for 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid?
The canonical SMILES for 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid is CCC1(CNC(=O)NC(C(=O)O)C2CC2)CCCC1.
What is the InChIKey of 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid?
The InChIKey is LANVXHNRLMKKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-2-14(7-3-4-8-14)9-15-13(19)16-11(12(17)18)10-5-6-10/h10-11H,2-9H2,1H3,(H,17,18)(H2,15,16,19).
What are the key properties of 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid?
2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 2.12, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[(1-ethylcyclopentyl)methylcarbamoylamino]acetic acid is sourced from PubChem (CID 114126135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).