2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline

C13H19NO — CID 97030521

IUPAC2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline
SMILESCOc1ccccc1N[C@H]1CCC[C@H]1C
InChIInChI=1S/C13H19NO/c1-10-6-5-8-11(10)14-12-7-3-4-9-13(12)15-2/h3-4,7,9-11,14H,5-6,8H2,1-2H3/t10-,11+/m1/s1
InChIKeyLWZSLMIGUPANGS-MNOVXSKESA-N
MW205.30 g/mol
LogP3.30
Rot. Bonds3

About 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline

2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline (PubChem CID 97030521) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline.

Molecular Properties

Compound Name2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline
PubChem CID97030521
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline
SMILESCOc1ccccc1N[C@H]1CCC[C@H]1C
InChIInChI=1S/C13H19NO/c1-10-6-5-8-11(10)14-12-7-3-4-9-13(12)15-2/h3-4,7,9-11,14H,5-6,8H2,1-2H3/t10-,11+/m1/s1
InChIKeyLWZSLMIGUPANGS-MNOVXSKESA-N
XLogP3.30
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline 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-methoxy-N-[(1R,2S)-2-methylcyclopentyl]pyridin-3-amine
CID 96923185
4,5-dimethoxy-2-methyl-N-(2-methylcyclopentyl)aniline
CID 65044277
methyl 2-[(2-methylcyclopentyl)amino]benzoate
CID 65046829
1-(2-methoxyphenyl)-3-[(1R,2R)-2-methylcyclohexyl]urea
CID 40636375
N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine
CID 63278312
2-chloro-4,5-dimethoxy-N-(2-methylcyclohexyl)aniline
CID 43712361
4-chloro-2,5-dimethoxy-N-(2-methylcyclohexyl)aniline
CID 43109970
3-methoxy-N-[(1S,2S)-2-methylcyclopentyl]aniline
CID 96923143
[2-[[(1R,2R,3S)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] 3-(2-methoxyanilino)propanoate
CID 11901398
(3S,4R)-4-(2-methoxyanilino)oxolan-3-ol
CID 93383823
2-methoxy-N-[(1R,3S)-3-methylcyclopentyl]aniline
CID 95376142
2-ethyl-N-(2-methylcyclohexyl)aniline
CID 43095688

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline?
The IUPAC name of 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline (CID 97030521) is 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline.
What is the SMILES notation for 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline?
The canonical SMILES for 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline is COc1ccccc1N[C@H]1CCC[C@H]1C.
What is the InChIKey of 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline?
The InChIKey is LWZSLMIGUPANGS-MNOVXSKESA-N. The full InChI is InChI=1S/C13H19NO/c1-10-6-5-8-11(10)14-12-7-3-4-9-13(12)15-2/h3-4,7,9-11,14H,5-6,8H2,1-2H3/t10-,11+/m1/s1.
What are the key properties of 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline?
2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline has a molecular weight of 205.30 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1S,2R)-2-methylcyclopentyl]aniline is sourced from PubChem (CID 97030521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).