3-cyclopentyl-1-quinolin-5-ylpropan-1-amine

C17H22N2 — CID 105020216

IUPAC3-cyclopentyl-1-quinolin-5-ylpropan-1-amine
SMILESNC(CCC1CCCC1)c1cccc2ncccc12
InChIInChI=1S/C17H22N2/c18-16(11-10-13-5-1-2-6-13)14-7-3-9-17-15(14)8-4-12-19-17/h3-4,7-9,12-13,16H,1-2,5-6,10-11,18H2
InChIKeyQMNQWTRDOSAMPD-UHFFFAOYSA-N
MW254.38 g/mol
LogP4.20
Rot. Bonds4

About 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine

3-cyclopentyl-1-quinolin-5-ylpropan-1-amine (PubChem CID 105020216) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-quinolin-5-ylpropan-1-amine
PubChem CID105020216
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name3-cyclopentyl-1-quinolin-5-ylpropan-1-amine
SMILESNC(CCC1CCCC1)c1cccc2ncccc12
InChIInChI=1S/C17H22N2/c18-16(11-10-13-5-1-2-6-13)14-7-3-9-17-15(14)8-4-12-19-17/h3-4,7-9,12-13,16H,1-2,5-6,10-11,18H2
InChIKeyQMNQWTRDOSAMPD-UHFFFAOYSA-N
XLogP4.20
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-quinolin-5-ylethanamine
CID 79015948
3-cyclopentyl-1-isoquinolin-8-ylpropan-1-amine
CID 103136749
4-methyl-1-quinolin-5-ylpentan-1-amine
CID 81232092
1-quinolin-5-ylethane-1,2-diamine
CID 55275195
(1R)-1-quinolin-5-ylethane-1,2-diamine
CID 66516625
1-quinolin-5-ylpent-4-en-1-amine
CID 105153398
N',N'-dimethyl-1-quinolin-5-ylpropane-1,3-diamine
CID 113291189
2-tert-butylsulfanyl-1-quinolin-5-ylethanamine
CID 81231907
3-methoxy-3-methyl-1-quinolin-5-ylbutan-1-amine
CID 103028668
3-cyclopentyl-1-isoquinolin-4-ylpropan-1-amine
CID 115856292
(1R)-1-quinolin-5-ylethanamine
CID 55277010
6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol
CID 115826271

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine?
The IUPAC name of 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine (CID 105020216) is 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine is NC(CCC1CCCC1)c1cccc2ncccc12.
What is the InChIKey of 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine?
The InChIKey is QMNQWTRDOSAMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c18-16(11-10-13-5-1-2-6-13)14-7-3-9-17-15(14)8-4-12-19-17/h3-4,7-9,12-13,16H,1-2,5-6,10-11,18H2.
What are the key properties of 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine?
3-cyclopentyl-1-quinolin-5-ylpropan-1-amine has a molecular weight of 254.38 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-quinolin-5-ylpropan-1-amine is sourced from PubChem (CID 105020216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).