N-(3,3-dimethylbutyl)quinolin-6-amine

C15H20N2 — CID 62950963

IUPACN-(3,3-dimethylbutyl)quinolin-6-amine
SMILESCC(C)(C)CCNc1ccc2ncccc2c1
InChIInChI=1S/C15H20N2/c1-15(2,3)8-10-16-13-6-7-14-12(11-13)5-4-9-17-14/h4-7,9,11,16H,8,10H2,1-3H3
InChIKeyRQEDFGODAKAFMB-UHFFFAOYSA-N
MW228.34 g/mol
LogP4.08
Rot. Bonds3

About N-(3,3-dimethylbutyl)quinolin-6-amine

N-(3,3-dimethylbutyl)quinolin-6-amine (PubChem CID 62950963) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(3,3-dimethylbutyl)quinolin-6-amine.

Molecular Properties

Compound NameN-(3,3-dimethylbutyl)quinolin-6-amine
PubChem CID62950963
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC NameN-(3,3-dimethylbutyl)quinolin-6-amine
SMILESCC(C)(C)CCNc1ccc2ncccc2c1
InChIInChI=1S/C15H20N2/c1-15(2,3)8-10-16-13-6-7-14-12(11-13)5-4-9-17-14/h4-7,9,11,16H,8,10H2,1-3H3
InChIKeyRQEDFGODAKAFMB-UHFFFAOYSA-N
XLogP4.08
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylsulfanylbutyl)quinolin-6-amine
CID 103087988
2-ethyl-2-[(quinolin-6-ylamino)methyl]butan-1-ol
CID 81418945
N-[(3,4-dimethylphenyl)methyl]quinolin-6-amine
CID 62634241
methyl 4-(quinolin-6-ylamino)butanoate
CID 82539291
N-quinolin-6-ylethanesulfonamide
CID 64584546
2-amino-2-methyl-N-quinolin-6-ylpropanamide
CID 62636163
6-amino-4,4-dimethyl-N-quinolin-6-ylhexanamide
CID 65291463
N-[3-(3-methylphenyl)butyl]quinolin-6-amine
CID 135134064
N-(pyridin-3-ylmethyl)quinolin-6-amine
CID 53392291
N-[(3,5-dimethoxyphenyl)methyl]quinolin-6-amine
CID 165347661
2,6-difluoro-4-[(quinolin-6-ylamino)methyl]phenol
CID 79883860
N-[(2,5-difluorophenyl)methyl]quinolin-6-amine
CID 62634585

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutyl)quinolin-6-amine?
The IUPAC name of N-(3,3-dimethylbutyl)quinolin-6-amine (CID 62950963) is N-(3,3-dimethylbutyl)quinolin-6-amine.
What is the SMILES notation for N-(3,3-dimethylbutyl)quinolin-6-amine?
The canonical SMILES for N-(3,3-dimethylbutyl)quinolin-6-amine is CC(C)(C)CCNc1ccc2ncccc2c1.
What is the InChIKey of N-(3,3-dimethylbutyl)quinolin-6-amine?
The InChIKey is RQEDFGODAKAFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-15(2,3)8-10-16-13-6-7-14-12(11-13)5-4-9-17-14/h4-7,9,11,16H,8,10H2,1-3H3.
What are the key properties of N-(3,3-dimethylbutyl)quinolin-6-amine?
N-(3,3-dimethylbutyl)quinolin-6-amine has a molecular weight of 228.34 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutyl)quinolin-6-amine is sourced from PubChem (CID 62950963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).