2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid

C15H17NO4 — CID 119185309

IUPAC2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
SMILESO=C(O)C1CC1C(=O)Nc1ccc(OCC2CC2)cc1
InChIInChI=1S/C15H17NO4/c17-14(12-7-13(12)15(18)19)16-10-3-5-11(6-4-10)20-8-9-1-2-9/h3-6,9,12-13H,1-2,7-8H2,(H,16,17)(H,18,19)
InChIKeyXEFWFHRUTHDMQI-UHFFFAOYSA-N
MW275.30 g/mol
LogP2.13
Rot. Bonds6

About 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid

2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid (PubChem CID 119185309) has the molecular formula C15H17NO4 and a molecular weight of 275.30 g/mol. Its IUPAC name is 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
PubChem CID119185309
Molecular FormulaC15H17NO4
Molecular Weight275.30 g/mol
Exact Mass275.12
IUPAC Name2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
SMILESO=C(O)C1CC1C(=O)Nc1ccc(OCC2CC2)cc1
InChIInChI=1S/C15H17NO4/c17-14(12-7-13(12)15(18)19)16-10-3-5-11(6-4-10)20-8-9-1-2-9/h3-6,9,12-13H,1-2,7-8H2,(H,16,17)(H,18,19)
InChIKeyXEFWFHRUTHDMQI-UHFFFAOYSA-N
XLogP2.13
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-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

2-[(4-methoxyphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 53270389
2-[[4-(carbamoylamino)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 54868238
2-[(4-ethylphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 54918615
1-N-(4-chlorophenyl)-2-N-(4-ethoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142941
4-[[4-(cyclopropylmethoxy)benzoyl]amino]benzamide
CID 60571619
cis-(1R,2S)-2-(pyridin-4-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 93346846
2-[[4-[(dimethylamino)methyl]phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 54868227
N-[4-(cyclopropylmethoxy)phenyl]-4-(propan-2-ylsulfanylamino)cyclohexane-1-carboxamide
CID 89215053
1-amino-N-[4-(cyclopropylmethoxy)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119325257
methyl 4-[[2-[(4-ethoxyphenyl)carbamoyl]cyclopropanecarbonyl]amino]benzoate
CID 109143528
2-[(4-ethoxy-3-methoxyphenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60791430
4-methyl-2-[(4-methylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 114390370

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid?
The IUPAC name of 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid (CID 119185309) is 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid.
What is the SMILES notation for 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid?
The canonical SMILES for 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid is O=C(O)C1CC1C(=O)Nc1ccc(OCC2CC2)cc1.
What is the InChIKey of 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid?
The InChIKey is XEFWFHRUTHDMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4/c17-14(12-7-13(12)15(18)19)16-10-3-5-11(6-4-10)20-8-9-1-2-9/h3-6,9,12-13H,1-2,7-8H2,(H,16,17)(H,18,19).
What are the key properties of 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid?
2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid has a molecular weight of 275.30 g/mol, XLogP of 2.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]cyclopropane-1-carboxylic acid is sourced from PubChem (CID 119185309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).