2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid

C14H17NO2 — CID 60795603

IUPAC2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
SMILESO=C(O)C1(NC2CC2)CCc2ccccc2C1
InChIInChI=1S/C14H17NO2/c16-13(17)14(15-12-5-6-12)8-7-10-3-1-2-4-11(10)9-14/h1-4,12,15H,5-9H2,(H,16,17)
InChIKeyOBUIRFNOXOLMIZ-UHFFFAOYSA-N
MW231.29 g/mol
LogP1.75
Rot. Bonds3

About 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid

2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid (PubChem CID 60795603) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid.

Molecular Properties

Compound Name2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
PubChem CID60795603
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
SMILESO=C(O)C1(NC2CC2)CCc2ccccc2C1
InChIInChI=1S/C14H17NO2/c16-13(17)14(15-12-5-6-12)8-7-10-3-1-2-4-11(10)9-14/h1-4,12,15H,5-9H2,(H,16,17)
InChIKeyOBUIRFNOXOLMIZ-UHFFFAOYSA-N
XLogP1.75
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-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-(cyclobutylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 115002582
2-(cyclopropanecarbonylamino)-1,3-dihydroindene-2-carboxylic acid
CID 75428971
1-(cyclopentylamino)-2,3-dihydroindene-1-carboxylic acid
CID 61001988
[2-(cycloheptylamino)-3,4-dihydro-1H-naphthalen-2-yl]methanol
CID 61055365
2-(aminomethyl)-N-cyclopropyl-3,4-dihydro-1H-naphthalen-2-amine
CID 62069632
(2S)-2-methyl-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 95566858
2-(benzylamino)-1,3-dihydroindene-2-carboxylic acid
CID 60992148
2-amino-3,4-dihydro-1H-naphthalene-2-carboxylic acid;hydrate
CID 91886239
1-(cyclopropylamino)-4-phenylcyclohexane-1-carboxamide
CID 60796821
1-(cyclopropylamino)-4,4-dimethyl-2,3-dihydronaphthalene-1-carboxylic acid
CID 43754606
2-(2-bromoanilino)-1,3-dihydroindene-2-carboxylic acid
CID 60993681
1-(cyclopropylamino)-3-(2-fluorophenyl)sulfanylcyclopentane-1-carboxylic acid
CID 79653844

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid?
The IUPAC name of 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid (CID 60795603) is 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid.
What is the SMILES notation for 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid?
The canonical SMILES for 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid is O=C(O)C1(NC2CC2)CCc2ccccc2C1.
What is the InChIKey of 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid?
The InChIKey is OBUIRFNOXOLMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c16-13(17)14(15-12-5-6-12)8-7-10-3-1-2-4-11(10)9-14/h1-4,12,15H,5-9H2,(H,16,17).
What are the key properties of 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid?
2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid has a molecular weight of 231.29 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3,4-dihydro-1H-naphthalene-2-carboxylic acid is sourced from PubChem (CID 60795603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).