N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine

C18H29N — CID 55187965

IUPACN,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine
SMILESCCC(C)CC(NC)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H29N/c1-4-15(2)14-17(19-3)18(12-8-9-13-18)16-10-6-5-7-11-16/h5-7,10-11,15,17,19H,4,8-9,12-14H2,1-3H3
InChIKeyYZZMKQCRRYGUNQ-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.52
Rot. Bonds6

About N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine

N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine (PubChem CID 55187965) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine.

Molecular Properties

Compound NameN,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine
PubChem CID55187965
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC NameN,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine
SMILESCCC(C)CC(NC)C1(c2ccccc2)CCCC1
InChIInChI=1S/C18H29N/c1-4-15(2)14-17(19-3)18(12-8-9-13-18)16-10-6-5-7-11-16/h5-7,10-11,15,17,19H,4,8-9,12-14H2,1-3H3
InChIKeyYZZMKQCRRYGUNQ-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine?
The IUPAC name of N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine (CID 55187965) is N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine.
What is the SMILES notation for N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine?
The canonical SMILES for N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine is CCC(C)CC(NC)C1(c2ccccc2)CCCC1.
What is the InChIKey of N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine?
The InChIKey is YZZMKQCRRYGUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-4-15(2)14-17(19-3)18(12-8-9-13-18)16-10-6-5-7-11-16/h5-7,10-11,15,17,19H,4,8-9,12-14H2,1-3H3.
What are the key properties of N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine?
N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine has a molecular weight of 259.44 g/mol, XLogP of 4.52, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-(1-phenylcyclopentyl)pentan-1-amine is sourced from PubChem (CID 55187965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).