N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine

C15H22N2 — CID 81215049

IUPACN-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine
SMILESCN(c1ccc2c(c1)CCCN2)C1CCCC1
InChIInChI=1S/C15H22N2/c1-17(13-6-2-3-7-13)14-8-9-15-12(11-14)5-4-10-16-15/h8-9,11,13,16H,2-7,10H2,1H3
InChIKeyVBPCQUUQEITUDP-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.42
Rot. Bonds2

About N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine

N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine (PubChem CID 81215049) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine.

Molecular Properties

Compound NameN-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine
PubChem CID81215049
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine
SMILESCN(c1ccc2c(c1)CCCN2)C1CCCC1
InChIInChI=1S/C15H22N2/c1-17(13-6-2-3-7-13)14-8-9-15-12(11-14)5-4-10-16-15/h8-9,11,13,16H,2-7,10H2,1H3
InChIKeyVBPCQUUQEITUDP-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine?
The IUPAC name of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine (CID 81215049) is N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine.
What is the SMILES notation for N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine?
The canonical SMILES for N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine is CN(c1ccc2c(c1)CCCN2)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine?
The InChIKey is VBPCQUUQEITUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-17(13-6-2-3-7-13)14-8-9-15-12(11-14)5-4-10-16-15/h8-9,11,13,16H,2-7,10H2,1H3.
What are the key properties of N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine?
N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine has a molecular weight of 230.35 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-methyl-1,2,3,4-tetrahydroquinolin-6-amine is sourced from PubChem (CID 81215049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).