1-phenyl-2-quinolin-6-ylbutan-2-amine

C19H20N2 — CID 81196822

IUPAC1-phenyl-2-quinolin-6-ylbutan-2-amine
SMILESCCC(N)(Cc1ccccc1)c1ccc2ncccc2c1
InChIInChI=1S/C19H20N2/c1-2-19(20,14-15-7-4-3-5-8-15)17-10-11-18-16(13-17)9-6-12-21-18/h3-13H,2,14,20H2,1H3
InChIKeyZROSOYNNXZEHHD-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.04
Rot. Bonds4

About 1-phenyl-2-quinolin-6-ylbutan-2-amine

1-phenyl-2-quinolin-6-ylbutan-2-amine (PubChem CID 81196822) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-phenyl-2-quinolin-6-ylbutan-2-amine.

Molecular Properties

Compound Name1-phenyl-2-quinolin-6-ylbutan-2-amine
PubChem CID81196822
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name1-phenyl-2-quinolin-6-ylbutan-2-amine
SMILESCCC(N)(Cc1ccccc1)c1ccc2ncccc2c1
InChIInChI=1S/C19H20N2/c1-2-19(20,14-15-7-4-3-5-8-15)17-10-11-18-16(13-17)9-6-12-21-18/h3-13H,2,14,20H2,1H3
InChIKeyZROSOYNNXZEHHD-UHFFFAOYSA-N
XLogP4.04
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;ethylbenzene;6-ethylquinoline
CID 143817758
2-methyl-3-quinolin-6-ylpentan-3-ol
CID 81215889
2-fluoro-1-phenyl-2-quinolin-6-ylpropan-1-one
CID 170553040
2-(3-fluoro-4-methoxyphenyl)-1-phenylbutan-2-amine
CID 79008004
1-(2-bromophenyl)-1-quinolin-6-ylethanamine
CID 81216742
1-(2-chlorophenyl)-1-quinolin-6-ylethanamine
CID 81215859
6-tert-butylquinoline;7-tert-butylquinoline
CID 159076219
3-(quinolin-6-ylmethoxymethyl)pentan-3-amine
CID 64571432
ethane;ethylbenzene;quinoline
CID 143401699
2-quinolin-6-ylheptan-2-ol
CID 81215851
2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine
CID 114872773
ethane;quinoline-6-carboxylic acid
CID 91364452

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-quinolin-6-ylbutan-2-amine?
The IUPAC name of 1-phenyl-2-quinolin-6-ylbutan-2-amine (CID 81196822) is 1-phenyl-2-quinolin-6-ylbutan-2-amine.
What is the SMILES notation for 1-phenyl-2-quinolin-6-ylbutan-2-amine?
The canonical SMILES for 1-phenyl-2-quinolin-6-ylbutan-2-amine is CCC(N)(Cc1ccccc1)c1ccc2ncccc2c1.
What is the InChIKey of 1-phenyl-2-quinolin-6-ylbutan-2-amine?
The InChIKey is ZROSOYNNXZEHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-2-19(20,14-15-7-4-3-5-8-15)17-10-11-18-16(13-17)9-6-12-21-18/h3-13H,2,14,20H2,1H3.
What are the key properties of 1-phenyl-2-quinolin-6-ylbutan-2-amine?
1-phenyl-2-quinolin-6-ylbutan-2-amine has a molecular weight of 276.38 g/mol, XLogP of 4.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-quinolin-6-ylbutan-2-amine is sourced from PubChem (CID 81196822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).