2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid

C14H19NO4 — CID 114390811

IUPAC2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
SMILESCC1CC(C(=O)O)C(C(=O)N(C)Cc2ccoc2)C1
InChIInChI=1S/C14H19NO4/c1-9-5-11(12(6-9)14(17)18)13(16)15(2)7-10-3-4-19-8-10/h3-4,8-9,11-12H,5-7H2,1-2H3,(H,17,18)
InChIKeyPSLYTLCOYNSFST-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.98
Rot. Bonds4

About 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid

2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid (PubChem CID 114390811) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
PubChem CID114390811
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
SMILESCC1CC(C(=O)O)C(C(=O)N(C)Cc2ccoc2)C1
InChIInChI=1S/C14H19NO4/c1-9-5-11(12(6-9)14(17)18)13(16)15(2)7-10-3-4-19-8-10/h3-4,8-9,11-12H,5-7H2,1-2H3,(H,17,18)
InChIKeyPSLYTLCOYNSFST-UHFFFAOYSA-N
XLogP1.98
TPSA70.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic 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

1-[furan-3-ylmethyl(methyl)carbamoyl]-2-methylpiperidine-4-carboxylic acid
CID 106744068
2-[methyl-[[4-(methylcarbamoyl)phenyl]methyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 60948397
1-[furan-3-ylmethyl(methyl)carbamoyl]-4-hydroxypyrrolidine-2-carboxylic acid
CID 61422268
N-(furan-3-ylmethyl)-N,3-dimethylbutanamide
CID 110868913
1-(furan-3-ylmethyl)-3-hydroxy-1-methylurea
CID 54330793
4-[furan-3-ylmethyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103498062
(3R)-1-[furan-3-ylmethyl(methyl)carbamoyl]piperidine-3-carboxylic acid
CID 81120132
cis-(1S,2R)-2-[(2-hydroxyphenyl)methyl-methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 93379347
cis-(1S,2R)-2-[(3-methoxyphenyl)methyl-methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 93376998
N-(furan-3-ylmethyl)-N,3,3-trimethylbutanamide
CID 110868951
N-(furan-3-ylmethyl)-N-methyl-2-sulfanylpropanamide
CID 107024417
(2R)-2-amino-N-(furan-3-ylmethyl)-N-methylpropanamide
CID 78973579

Frequently Asked Questions

What is the IUPAC name of 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid?
The IUPAC name of 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid (CID 114390811) is 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid is CC1CC(C(=O)O)C(C(=O)N(C)Cc2ccoc2)C1.
What is the InChIKey of 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid?
The InChIKey is PSLYTLCOYNSFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-9-5-11(12(6-9)14(17)18)13(16)15(2)7-10-3-4-19-8-10/h3-4,8-9,11-12H,5-7H2,1-2H3,(H,17,18).
What are the key properties of 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid?
2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid has a molecular weight of 265.31 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[furan-3-ylmethyl(methyl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid is sourced from PubChem (CID 114390811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).