6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine

C14H18ClN — CID 115892348

IUPAC6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine
SMILESCC1CC(NC2CCc3ccc(Cl)cc32)C1
InChIInChI=1S/C14H18ClN/c1-9-6-12(7-9)16-14-5-3-10-2-4-11(15)8-13(10)14/h2,4,8-9,12,14,16H,3,5-7H2,1H3
InChIKeyVJCUBRVJQCTJIW-UHFFFAOYSA-N
MW235.76 g/mol
LogP3.72
Rot. Bonds2

About 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine

6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 115892348) has the molecular formula C14H18ClN and a molecular weight of 235.76 g/mol. Its IUPAC name is 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID115892348
Molecular FormulaC14H18ClN
Molecular Weight235.76 g/mol
Exact Mass235.11
IUPAC Name6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine
SMILESCC1CC(NC2CCc3ccc(Cl)cc32)C1
InChIInChI=1S/C14H18ClN/c1-9-6-12(7-9)16-14-5-3-10-2-4-11(15)8-13(10)14/h2,4,8-9,12,14,16H,3,5-7H2,1H3
InChIKeyVJCUBRVJQCTJIW-UHFFFAOYSA-N
XLogP3.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.76
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-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

6-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 115867576
6-chloro-N-(3,5-dimethylcyclohexyl)-3,4-dihydro-2H-thiochromen-4-amine
CID 64751758
6-chloro-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 54776023
1-[(3-methylcyclobutyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107682661
[(1R)-6-chloro-2,3-dihydro-1H-inden-1-yl]hydrazine
CID 124537604
6-chloro-N-propyl-2,3-dihydro-1H-inden-1-amine
CID 61383375
5-chloro-N-cyclopentyl-2,3-dihydro-1H-inden-1-amine
CID 81301651
N-cyclopropyl-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 75488646
2-(6-chloro-2,3-dihydro-1H-inden-1-yl)-N-methylpropan-2-amine
CID 105481539
6-chloro-N-(cyclopropylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 115867658
(2R)-1-[(6-chloro-2,3-dihydro-1H-inden-1-yl)amino]propan-2-ol
CID 103906751
6-methoxy-N-(3-methoxycyclobutyl)-2,3-dihydro-1H-inden-1-amine
CID 104584581

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine (CID 115892348) is 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine is CC1CC(NC2CCc3ccc(Cl)cc32)C1.
What is the InChIKey of 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is VJCUBRVJQCTJIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN/c1-9-6-12(7-9)16-14-5-3-10-2-4-11(15)8-13(10)14/h2,4,8-9,12,14,16H,3,5-7H2,1H3.
What are the key properties of 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine?
6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 235.76 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-methylcyclobutyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 115892348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).