N-(3,3-dimethylcyclopentyl)quinolin-5-amine

C16H20N2 — CID 80693374

IUPACN-(3,3-dimethylcyclopentyl)quinolin-5-amine
SMILESCC1(C)CCC(Nc2cccc3ncccc23)C1
InChIInChI=1S/C16H20N2/c1-16(2)9-8-12(11-16)18-15-7-3-6-14-13(15)5-4-10-17-14/h3-7,10,12,18H,8-9,11H2,1-2H3
InChIKeyUBNGMEKBBVBHKP-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.23
Rot. Bonds2

About N-(3,3-dimethylcyclopentyl)quinolin-5-amine

N-(3,3-dimethylcyclopentyl)quinolin-5-amine (PubChem CID 80693374) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)quinolin-5-amine.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)quinolin-5-amine
PubChem CID80693374
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-(3,3-dimethylcyclopentyl)quinolin-5-amine
SMILESCC1(C)CCC(Nc2cccc3ncccc23)C1
InChIInChI=1S/C16H20N2/c1-16(2)9-8-12(11-16)18-15-7-3-6-14-13(15)5-4-10-17-14/h3-7,10,12,18H,8-9,11H2,1-2H3
InChIKeyUBNGMEKBBVBHKP-UHFFFAOYSA-N
XLogP4.23
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylcyclopentyl)quinolin-5-amine
CID 64501004
1-N-quinolin-5-ylcyclobutane-1,3-diamine
CID 80559006
N-(1-methylpyrrolidin-3-yl)quinolin-5-amine
CID 62975948
N-(3-cyclopropylcyclohexyl)quinolin-5-amine
CID 64595220
N-(1-methylazepan-4-yl)quinolin-5-amine
CID 65071582
N-(thian-3-yl)quinolin-5-amine
CID 62873049
N-(3-methoxycyclohexyl)quinolin-5-amine
CID 106871532
N-(3,3-dimethylcyclopentyl)-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 80706323
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-5-amine
CID 43759315
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)quinolin-5-amine
CID 115928349
N-(3,3-dimethylcyclopentyl)isoquinolin-1-amine
CID 114548093
N-(4,4-dimethylcycloheptyl)-8-methylquinolin-5-amine
CID 65083328

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)quinolin-5-amine?
The IUPAC name of N-(3,3-dimethylcyclopentyl)quinolin-5-amine (CID 80693374) is N-(3,3-dimethylcyclopentyl)quinolin-5-amine.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)quinolin-5-amine?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)quinolin-5-amine is CC1(C)CCC(Nc2cccc3ncccc23)C1.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)quinolin-5-amine?
The InChIKey is UBNGMEKBBVBHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-16(2)9-8-12(11-16)18-15-7-3-6-14-13(15)5-4-10-17-14/h3-7,10,12,18H,8-9,11H2,1-2H3.
What are the key properties of N-(3,3-dimethylcyclopentyl)quinolin-5-amine?
N-(3,3-dimethylcyclopentyl)quinolin-5-amine has a molecular weight of 240.35 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)quinolin-5-amine is sourced from PubChem (CID 80693374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).