5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine

C18H19Cl2N — CID 115348779

IUPAC5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
SMILESCC(Cc1ccccc1Cl)NC1Cc2ccc(Cl)cc2C1
InChIInChI=1S/C18H19Cl2N/c1-12(8-14-4-2-3-5-18(14)20)21-17-10-13-6-7-16(19)9-15(13)11-17/h2-7,9,12,17,21H,8,10-11H2,1H3
InChIKeyZOPADMPLBWYEDU-UHFFFAOYSA-N
MW320.26 g/mol
LogP4.68
Rot. Bonds4

About 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine

5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 115348779) has the molecular formula C18H19Cl2N and a molecular weight of 320.26 g/mol. Its IUPAC name is 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
PubChem CID115348779
Molecular FormulaC18H19Cl2N
Molecular Weight320.26 g/mol
Exact Mass319.09
IUPAC Name5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
SMILESCC(Cc1ccccc1Cl)NC1Cc2ccc(Cl)cc2C1
InChIInChI=1S/C18H19Cl2N/c1-12(8-14-4-2-3-5-18(14)20)21-17-10-13-6-7-16(19)9-15(13)11-17/h2-7,9,12,17,21H,8,10-11H2,1H3
InChIKeyZOPADMPLBWYEDU-UHFFFAOYSA-N
XLogP4.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.26
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]pentan-2-ol
CID 113376014
N-[1-(2-chlorophenyl)propan-2-yl]-4-methylcyclohexan-1-amine
CID 43677397
5-chloro-N-(2-methyl-1-phenylpropyl)-2,3-dihydro-1H-inden-2-amine
CID 115348805
N-[1-(2-chlorophenyl)propan-2-yl]-3-phenylcyclobutan-1-amine
CID 43677527
N-[1-(2-methoxyphenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
CID 60935059
N-[1-(2-chlorophenyl)propan-2-yl]-3,3-dimethylcyclopentan-1-amine
CID 80693498
2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-N,4-dimethylpentanamide
CID 81333692
5-chloro-N-[(2-fluorophenyl)methyl]-2,3-dihydro-1H-inden-2-amine
CID 81300561
2-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-4-methylpentan-1-ol
CID 81328281
5-chloro-N-(1-methoxy-3-methylbutan-2-yl)-2,3-dihydro-1H-inden-2-amine
CID 81343273
5-chloro-N-[(1R)-1-(furan-2-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 115349183
5-chloro-N-(2,6-dichlorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 115349088

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine (CID 115348779) is 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine is CC(Cc1ccccc1Cl)NC1Cc2ccc(Cl)cc2C1.
What is the InChIKey of 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is ZOPADMPLBWYEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2N/c1-12(8-14-4-2-3-5-18(14)20)21-17-10-13-6-7-16(19)9-15(13)11-17/h2-7,9,12,17,21H,8,10-11H2,1H3.
What are the key properties of 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 320.26 g/mol, XLogP of 4.68, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(2-chlorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 115348779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).