N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine

C15H22N2 — CID 80650268

IUPACN-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine
SMILESc1cc2c(c(CNC3CCCCC3)c1)NCC2
InChIInChI=1S/C15H22N2/c1-2-7-14(8-3-1)17-11-13-6-4-5-12-9-10-16-15(12)13/h4-6,14,16-17H,1-3,7-11H2
InChIKeyHDHYFUNKAMZHLQ-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.08
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine

N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine (PubChem CID 80650268) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine
PubChem CID80650268
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine
SMILESc1cc2c(c(CNC3CCCCC3)c1)NCC2
InChIInChI=1S/C15H22N2/c1-2-7-14(8-3-1)17-11-13-6-4-5-12-9-10-16-15(12)13/h4-6,14,16-17H,1-3,7-11H2
InChIKeyHDHYFUNKAMZHLQ-UHFFFAOYSA-N
XLogP3.08
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine?
The IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine (CID 80650268) is N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine is c1cc2c(c(CNC3CCCCC3)c1)NCC2.
What is the InChIKey of N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine?
The InChIKey is HDHYFUNKAMZHLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-2-7-14(8-3-1)17-11-13-6-4-5-12-9-10-16-15(12)13/h4-6,14,16-17H,1-3,7-11H2.
What are the key properties of N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine?
N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine has a molecular weight of 230.35 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-7-ylmethyl)cyclohexanamine is sourced from PubChem (CID 80650268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).