8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine

C14H17ClN2 — CID 61323719

IUPAC8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine
SMILESCC(C)(C)CNc1ccc(Cl)c2ncccc12
InChIInChI=1S/C14H17ClN2/c1-14(2,3)9-17-12-7-6-11(15)13-10(12)5-4-8-16-13/h4-8,17H,9H2,1-3H3
InChIKeyMPSOLFSCNSCPBG-UHFFFAOYSA-N
MW248.76 g/mol
LogP4.35
Rot. Bonds2

About 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine

8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine (PubChem CID 61323719) has the molecular formula C14H17ClN2 and a molecular weight of 248.76 g/mol. Its IUPAC name is 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine.

Molecular Properties

Compound Name8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine
PubChem CID61323719
Molecular FormulaC14H17ClN2
Molecular Weight248.76 g/mol
Exact Mass248.11
IUPAC Name8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine
SMILESCC(C)(C)CNc1ccc(Cl)c2ncccc12
InChIInChI=1S/C14H17ClN2/c1-14(2,3)9-17-12-7-6-11(15)13-10(12)5-4-8-16-13/h4-8,17H,9H2,1-3H3
InChIKeyMPSOLFSCNSCPBG-UHFFFAOYSA-N
XLogP4.35
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.76
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-chloro-N-heptylquinolin-5-amine
CID 43731731
8-chloro-N-[(2-ethylphenyl)methyl]quinolin-5-amine
CID 63445925
N-[(4-bromophenyl)methyl]-8-chloroquinolin-5-amine
CID 43731668
8-chloro-N-[(3-ethylimidazol-4-yl)methyl]quinolin-5-amine
CID 66132568
N-(2,2-dimethylpropyl)quinolin-5-amine
CID 61326156
3-[(5-chloroquinolin-8-yl)amino]-2-hydroxy-2-methylpropanoic acid
CID 116783958
3-[[(8-chloroquinolin-5-yl)amino]methyl]phenol
CID 43731727
8-chloro-N-ethylquinolin-4-amine
CID 62190462
8-chloro-N-(1H-imidazol-5-ylmethyl)quinolin-5-amine
CID 62763903
8-chloro-N-[(5-iodofuran-2-yl)methyl]quinolin-5-amine
CID 43788302
4-[(5-chloroquinolin-8-yl)amino]-2-methylbutan-2-ol
CID 116783853
2-[[(8-chloroquinolin-5-yl)amino]methyl]benzonitrile
CID 107935902

Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine?
The IUPAC name of 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine (CID 61323719) is 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine.
What is the SMILES notation for 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine?
The canonical SMILES for 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine is CC(C)(C)CNc1ccc(Cl)c2ncccc12.
What is the InChIKey of 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine?
The InChIKey is MPSOLFSCNSCPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2/c1-14(2,3)9-17-12-7-6-11(15)13-10(12)5-4-8-16-13/h4-8,17H,9H2,1-3H3.
What are the key properties of 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine?
8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine has a molecular weight of 248.76 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-(2,2-dimethylpropyl)quinolin-5-amine is sourced from PubChem (CID 61323719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).