3-chloro-7-(2-methylpropyl)quinolin-2-amine

C13H15ClN2 — CID 166974012

IUPAC3-chloro-7-(2-methylpropyl)quinolin-2-amine
SMILESCC(C)Cc1ccc2cc(Cl)c(N)nc2c1
InChIInChI=1S/C13H15ClN2/c1-8(2)5-9-3-4-10-7-11(14)13(15)16-12(10)6-9/h3-4,6-8H,5H2,1-2H3,(H2,15,16)
InChIKeySENDJZRABRTRHK-UHFFFAOYSA-N
MW234.73 g/mol
LogP3.67
Rot. Bonds2

About 3-chloro-7-(2-methylpropyl)quinolin-2-amine

3-chloro-7-(2-methylpropyl)quinolin-2-amine (PubChem CID 166974012) has the molecular formula C13H15ClN2 and a molecular weight of 234.73 g/mol. Its IUPAC name is 3-chloro-7-(2-methylpropyl)quinolin-2-amine.

Molecular Properties

Compound Name3-chloro-7-(2-methylpropyl)quinolin-2-amine
PubChem CID166974012
Molecular FormulaC13H15ClN2
Molecular Weight234.73 g/mol
Exact Mass234.09
IUPAC Name3-chloro-7-(2-methylpropyl)quinolin-2-amine
SMILESCC(C)Cc1ccc2cc(Cl)c(N)nc2c1
InChIInChI=1S/C13H15ClN2/c1-8(2)5-9-3-4-10-7-11(14)13(15)16-12(10)6-9/h3-4,6-8H,5H2,1-2H3,(H2,15,16)
InChIKeySENDJZRABRTRHK-UHFFFAOYSA-N
XLogP3.67
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.73
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-7-(methylaminomethyl)quinolin-2-amine
CID 171501431
3,5-dichloro-6-[3-(2-methylpropyl)phenyl]pyridin-2-amine
CID 102753955
3,5-dichloro-6-(2-methylpropyl)pyridin-2-amine
CID 102753366
N-[3-chloro-7-(2-methylpropyl)quinolin-2-yl]cyclobutanecarboxamide
CID 166882379
7-(2-methylpropyl)quinazoline
CID 147255984
6-(2-methylpropyl)-1,2,3,4-benzotetrazine
CID 138666997
6-(2-methylpropyl)-2-propan-2-ylindazole
CID 155051024
3-methyl-6-(2-methylpropyl)isoquinolin-1-amine
CID 118508678
6-(2-methylpropyl)-1,3-benzothiazol-2-amine
CID 20771989
2-methoxy-5-(2-methylpropyl)-1,3-benzoxazole
CID 59731320
2-(3,4-dichlorophenyl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 63428543
2,3-dichloro-7-(2,2-dimethylpropyl)quinoline
CID 155185194

Frequently Asked Questions

What is the IUPAC name of 3-chloro-7-(2-methylpropyl)quinolin-2-amine?
The IUPAC name of 3-chloro-7-(2-methylpropyl)quinolin-2-amine (CID 166974012) is 3-chloro-7-(2-methylpropyl)quinolin-2-amine.
What is the SMILES notation for 3-chloro-7-(2-methylpropyl)quinolin-2-amine?
The canonical SMILES for 3-chloro-7-(2-methylpropyl)quinolin-2-amine is CC(C)Cc1ccc2cc(Cl)c(N)nc2c1.
What is the InChIKey of 3-chloro-7-(2-methylpropyl)quinolin-2-amine?
The InChIKey is SENDJZRABRTRHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2/c1-8(2)5-9-3-4-10-7-11(14)13(15)16-12(10)6-9/h3-4,6-8H,5H2,1-2H3,(H2,15,16).
What are the key properties of 3-chloro-7-(2-methylpropyl)quinolin-2-amine?
3-chloro-7-(2-methylpropyl)quinolin-2-amine has a molecular weight of 234.73 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-7-(2-methylpropyl)quinolin-2-amine is sourced from PubChem (CID 166974012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).