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

C18H27N — CID 43081045

IUPACN-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
SMILESCCCC1CCC(NC2CCc3ccccc32)CC1
InChIInChI=1S/C18H27N/c1-2-5-14-8-11-16(12-9-14)19-18-13-10-15-6-3-4-7-17(15)18/h3-4,6-7,14,16,18-19H,2,5,8-13H2,1H3
InChIKeySMYDFOODKAJJNT-UHFFFAOYSA-N
MW257.42 g/mol
LogP4.62
Rot. Bonds4

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

N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 43081045) has the molecular formula C18H27N and a molecular weight of 257.42 g/mol. Its IUPAC name is N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID43081045
Molecular FormulaC18H27N
Molecular Weight257.42 g/mol
Exact Mass257.21
IUPAC NameN-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine
SMILESCCCC1CCC(NC2CCc3ccccc32)CC1
InChIInChI=1S/C18H27N/c1-2-5-14-8-11-16(12-9-14)19-18-13-10-15-6-3-4-7-17(15)18/h3-4,6-7,14,16,18-19H,2,5,8-13H2,1H3
InChIKeySMYDFOODKAJJNT-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine (CID 43081045) is N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine is CCCC1CCC(NC2CCc3ccccc32)CC1.
What is the InChIKey of N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is SMYDFOODKAJJNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N/c1-2-5-14-8-11-16(12-9-14)19-18-13-10-15-6-3-4-7-17(15)18/h3-4,6-7,14,16,18-19H,2,5,8-13H2,1H3.
What are the key properties of N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine?
N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 257.42 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propylcyclohexyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 43081045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).