N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine

C19H20N2 — CID 62636644

IUPACN-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine
SMILESCc1ccc(C)c(C(C)Nc2ccc3ncccc3c2)c1
InChIInChI=1S/C19H20N2/c1-13-6-7-14(2)18(11-13)15(3)21-17-8-9-19-16(12-17)5-4-10-20-19/h4-12,15,21H,1-3H3
InChIKeyPYJMQMJOJLVASV-UHFFFAOYSA-N
MW276.38 g/mol
LogP5.02
Rot. Bonds3

About N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine

N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine (PubChem CID 62636644) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine.

Molecular Properties

Compound NameN-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine
PubChem CID62636644
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC NameN-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine
SMILESCc1ccc(C)c(C(C)Nc2ccc3ncccc3c2)c1
InChIInChI=1S/C19H20N2/c1-13-6-7-14(2)18(11-13)15(3)21-17-8-9-19-16(12-17)5-4-10-20-19/h4-12,15,21H,1-3H3
InChIKeyPYJMQMJOJLVASV-UHFFFAOYSA-N
XLogP5.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.38
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2,5-difluorophenyl)ethyl]quinolin-6-amine
CID 62634757
6-methylquinoline
CID 7059
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]quinolin-6-amine
CID 63753119
N-[1-(1H-pyrazol-5-yl)ethyl]quinolin-6-amine
CID 55097402
N-[1-(2,4-dimethylphenyl)ethyl]quinolin-3-amine
CID 43691266
N-[1-(1,3-thiazol-4-yl)ethyl]quinolin-6-amine
CID 115928696
N-[1-(3,4-difluorophenyl)ethyl]quinolin-6-amine
CID 62634409
4-methyl-2-[1-(quinoxalin-6-ylamino)ethyl]phenol
CID 60944016
N-[1-(2-methylphenyl)ethyl]quinolin-3-amine
CID 43691256
4-[1-(2,5-dimethylphenyl)ethylamino]phenol
CID 43742646
3-[1-(2,5-dimethylphenyl)ethylamino]phenol
CID 43207007
N-[1-(3-chloro-4-fluorophenyl)ethyl]quinolin-6-amine
CID 62636651

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine?
The IUPAC name of N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine (CID 62636644) is N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine.
What is the SMILES notation for N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine?
The canonical SMILES for N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine is Cc1ccc(C)c(C(C)Nc2ccc3ncccc3c2)c1.
What is the InChIKey of N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine?
The InChIKey is PYJMQMJOJLVASV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-13-6-7-14(2)18(11-13)15(3)21-17-8-9-19-16(12-17)5-4-10-20-19/h4-12,15,21H,1-3H3.
What are the key properties of N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine?
N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine has a molecular weight of 276.38 g/mol, XLogP of 5.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dimethylphenyl)ethyl]quinolin-6-amine is sourced from PubChem (CID 62636644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).