2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine

C19H23N — CID 116542927

IUPAC2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine
SMILESCC(C)Cc1cccc(C2(N)Cc3ccccc3C2)c1
InChIInChI=1S/C19H23N/c1-14(2)10-15-6-5-9-18(11-15)19(20)12-16-7-3-4-8-17(16)13-19/h3-9,11,14H,10,12-13,20H2,1-2H3
InChIKeyWKDXQBSJTQMULC-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.84
Rot. Bonds3

About 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine

2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine (PubChem CID 116542927) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine.

Molecular Properties

Compound Name2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine
PubChem CID116542927
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine
SMILESCC(C)Cc1cccc(C2(N)Cc3ccccc3C2)c1
InChIInChI=1S/C19H23N/c1-14(2)10-15-6-5-9-18(11-15)19(20)12-16-7-3-4-8-17(16)13-19/h3-9,11,14H,10,12-13,20H2,1-2H3
InChIKeyWKDXQBSJTQMULC-UHFFFAOYSA-N
XLogP3.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine 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

4,4-dimethyl-1-[3-(2-methylpropyl)phenyl]cyclohexan-1-amine
CID 116543004
3,5-dimethyl-1-[3-(2-methylpropyl)phenyl]cyclohexan-1-amine
CID 116543014
[3-(2-methylpropyl)phenyl]-(1-phenylcyclopropyl)methanamine
CID 116544293
2,2-dimethyl-1-[3-(2-methylpropyl)phenyl]cyclohexan-1-ol
CID 116542681
3-methoxy-1-[3-(2-methylpropyl)phenyl]cyclobutan-1-ol
CID 106823598
2-methyl-1-[3-(2-methylpropyl)phenyl]cyclopentan-1-ol
CID 116542606
4-methoxy-1-[3-(2-methylpropyl)phenyl]cyclohexan-1-ol
CID 116542858
3-[3-(2-methylpropyl)phenyl]piperidin-3-ol
CID 116542352
1-iodo-3-(2-methylpropyl)benzene
CID 18417600
ethane;2-methylpropylbenzene
CID 162200929
(E)-4-[3-(2-methylpropyl)phenyl]but-3-en-1-amine
CID 116546322
1-[3-(2-methylpropyl)phenyl]-2-phenylethanamine
CID 116543879

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine?
The IUPAC name of 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine (CID 116542927) is 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine.
What is the SMILES notation for 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine?
The canonical SMILES for 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine is CC(C)Cc1cccc(C2(N)Cc3ccccc3C2)c1.
What is the InChIKey of 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine?
The InChIKey is WKDXQBSJTQMULC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-14(2)10-15-6-5-9-18(11-15)19(20)12-16-7-3-4-8-17(16)13-19/h3-9,11,14H,10,12-13,20H2,1-2H3.
What are the key properties of 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine?
2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine has a molecular weight of 265.40 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methylpropyl)phenyl]-1,3-dihydroinden-2-amine is sourced from PubChem (CID 116542927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).