5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine

C18H26ClN — CID 115348993

IUPAC5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine
SMILESCCCC1CCC(NC2Cc3ccc(Cl)cc3C2)CC1
InChIInChI=1S/C18H26ClN/c1-2-3-13-4-8-17(9-5-13)20-18-11-14-6-7-16(19)10-15(14)12-18/h6-7,10,13,17-18,20H,2-5,8-9,11-12H2,1H3
InChIKeyDNUWMJHIQDUXFX-UHFFFAOYSA-N
MW291.87 g/mol
LogP4.76
Rot. Bonds4

About 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine

5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine (PubChem CID 115348993) has the molecular formula C18H26ClN and a molecular weight of 291.87 g/mol. Its IUPAC name is 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine
PubChem CID115348993
Molecular FormulaC18H26ClN
Molecular Weight291.87 g/mol
Exact Mass291.18
IUPAC Name5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine
SMILESCCCC1CCC(NC2Cc3ccc(Cl)cc3C2)CC1
InChIInChI=1S/C18H26ClN/c1-2-3-13-4-8-17(9-5-13)20-18-11-14-6-7-16(19)10-15(14)12-18/h6-7,10,13,17-18,20H,2-5,8-9,11-12H2,1H3
InChIKeyDNUWMJHIQDUXFX-UHFFFAOYSA-N
XLogP4.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.87
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1-methylpiperidin-4-amine
CID 81300742
5-chloro-N-(3-ethyl-2-methylcyclopentyl)-2,3-dihydro-1H-inden-2-amine
CID 115349079
5-chloro-N-(2-cyclohexylethyl)-2,3-dihydro-1H-inden-2-amine
CID 115348932
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)oxolan-3-amine
CID 115349140
N-cyclopropyl-5-methyl-2,3-dihydro-1H-inden-2-amine
CID 83829022
5-chloro-N-hexyl-2,3-dihydro-1H-inden-2-amine
CID 113291766
3-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]cyclohexan-1-ol
CID 81328885
N-(5-chloro-2,3-dihydro-1H-inden-2-yl)-1,2-dimethylpiperidin-4-amine
CID 81343630
5-chloro-N-(cyclohexylmethyl)-2,3-dihydro-1H-inden-2-amine
CID 115348749
5-[(5-chloro-2,3-dihydro-1H-inden-2-yl)amino]-1-methylpiperidin-2-one
CID 81339258
N-cyclobutyl-4-propylcycloheptan-1-amine
CID 65091278
5-chloro-N-[(2-methylpropan-2-yl)oxy]-2,3-dihydro-1H-inden-2-amine
CID 82720295

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine (CID 115348993) is 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine is CCCC1CCC(NC2Cc3ccc(Cl)cc3C2)CC1.
What is the InChIKey of 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine?
The InChIKey is DNUWMJHIQDUXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26ClN/c1-2-3-13-4-8-17(9-5-13)20-18-11-14-6-7-16(19)10-15(14)12-18/h6-7,10,13,17-18,20H,2-5,8-9,11-12H2,1H3.
What are the key properties of 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine?
5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine has a molecular weight of 291.87 g/mol, XLogP of 4.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 115348993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).