N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine

C16H16N2 — CID 780384

IUPACN-(4-methylphenyl)-3,4-dihydroquinolin-2-amine
SMILESCc1ccc(NC2=Nc3ccccc3CC2)cc1
InChIInChI=1S/C16H16N2/c1-12-6-9-14(10-7-12)17-16-11-8-13-4-2-3-5-15(13)18-16/h2-7,9-10H,8,11H2,1H3,(H,17,18)
InChIKeyDSRZSUVDGCYFCT-UHFFFAOYSA-N
MW236.32 g/mol
LogP4.08
Rot. Bonds1

About N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine

N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine (PubChem CID 780384) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine.

Molecular Properties

Compound NameN-(4-methylphenyl)-3,4-dihydroquinolin-2-amine
PubChem CID780384
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC NameN-(4-methylphenyl)-3,4-dihydroquinolin-2-amine
SMILESCc1ccc(NC2=Nc3ccccc3CC2)cc1
InChIInChI=1S/C16H16N2/c1-12-6-9-14(10-7-12)17-16-11-8-13-4-2-3-5-15(13)18-16/h2-7,9-10H,8,11H2,1H3,(H,17,18)
InChIKeyDSRZSUVDGCYFCT-UHFFFAOYSA-N
XLogP4.08
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Di-o-tolylguanidine
CID 7333
Antazoline
CID 2200
Methanimidamide, N,N'-bis(2,4-dimethylphenyl)-
CID 578703
Guanidine, N,N'-bis(methylphenyl)-
CID 41011
2-Methylquinazoline-4-thiol
CID 727351
6,6'-Methylenebis(1,2-dihydro-2,2,4-trimethylquinoline)
CID 99342
N,N'-Bis-(4-hexyl-phenyl)-guanidine
CID 9821194
N,N'-Bis-(4-butyl-phenyl)-guanidine
CID 10496171
N,N'-Bis-(4-sec-butyl-phenyl)-guanidine
CID 10526122
N,N'-Bis-(4-isopropyl-phenyl)-guanidine
CID 13781937
N,N''-Bis(4-ethylphenyl)guanidine
CID 14771671
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-2-phenylaniline
CID 44352155

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine?
The IUPAC name of N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine (CID 780384) is N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine.
What is the SMILES notation for N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine?
The canonical SMILES for N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine is Cc1ccc(NC2=Nc3ccccc3CC2)cc1.
What is the InChIKey of N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine?
The InChIKey is DSRZSUVDGCYFCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-12-6-9-14(10-7-12)17-16-11-8-13-4-2-3-5-15(13)18-16/h2-7,9-10H,8,11H2,1H3,(H,17,18).
What are the key properties of N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine?
N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 4.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-3,4-dihydroquinolin-2-amine is sourced from PubChem (CID 780384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).