2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid

C19H32N2O4 — CID 11515875

IUPAC2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid
SMILESCCCC(CC1(C(=O)NC2CCC(C(N)=O)CC2)CCCC1)C(=O)O
InChIInChI=1S/C19H32N2O4/c1-2-5-14(17(23)24)12-19(10-3-4-11-19)18(25)21-15-8-6-13(7-9-15)16(20)22/h13-15H,2-12H2,1H3,(H2,20,22)(H,21,25)(H,23,24)
InChIKeyOLJFAUHUGYPHKD-UHFFFAOYSA-N
MW352.48 g/mol
LogP2.60
Rot. Bonds8

About 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid

2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid (PubChem CID 11515875) has the molecular formula C19H32N2O4 and a molecular weight of 352.48 g/mol. Its IUPAC name is 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid.

Molecular Properties

Compound Name2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid
PubChem CID11515875
Molecular FormulaC19H32N2O4
Molecular Weight352.48 g/mol
Exact Mass352.24
IUPAC Name2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid
SMILESCCCC(CC1(C(=O)NC2CCC(C(N)=O)CC2)CCCC1)C(=O)O
InChIInChI=1S/C19H32N2O4/c1-2-5-14(17(23)24)12-19(10-3-4-11-19)18(25)21-15-8-6-13(7-9-15)16(20)22/h13-15H,2-12H2,1H3,(H2,20,22)(H,21,25)(H,23,24)
InChIKeyOLJFAUHUGYPHKD-UHFFFAOYSA-N
XLogP2.60
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
The IUPAC name of 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid (CID 11515875) is 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid.
What is the SMILES notation for 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
The canonical SMILES for 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid is CCCC(CC1(C(=O)NC2CCC(C(N)=O)CC2)CCCC1)C(=O)O.
What is the InChIKey of 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
The InChIKey is OLJFAUHUGYPHKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O4/c1-2-5-14(17(23)24)12-19(10-3-4-11-19)18(25)21-15-8-6-13(7-9-15)16(20)22/h13-15H,2-12H2,1H3,(H2,20,22)(H,21,25)(H,23,24).
What are the key properties of 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid has a molecular weight of 352.48 g/mol, XLogP of 2.60, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-[(4-carbamoylcyclohexyl)carbamoyl]cyclopentyl]methyl]pentanoic acid is sourced from PubChem (CID 11515875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).