4-phenyl-1-quinolin-7-ylbutan-1-amine

C19H20N2 — CID 105172595

IUPAC4-phenyl-1-quinolin-7-ylbutan-1-amine
SMILESNC(CCCc1ccccc1)c1ccc2cccnc2c1
InChIInChI=1S/C19H20N2/c20-18(10-4-8-15-6-2-1-3-7-15)17-12-11-16-9-5-13-21-19(16)14-17/h1-3,5-7,9,11-14,18H,4,8,10,20H2
InChIKeyXEMKRFCQARMVHF-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.26
Rot. Bonds5

About 4-phenyl-1-quinolin-7-ylbutan-1-amine

4-phenyl-1-quinolin-7-ylbutan-1-amine (PubChem CID 105172595) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-phenyl-1-quinolin-7-ylbutan-1-amine.

Molecular Properties

Compound Name4-phenyl-1-quinolin-7-ylbutan-1-amine
PubChem CID105172595
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name4-phenyl-1-quinolin-7-ylbutan-1-amine
SMILESNC(CCCc1ccccc1)c1ccc2cccnc2c1
InChIInChI=1S/C19H20N2/c20-18(10-4-8-15-6-2-1-3-7-15)17-12-11-16-9-5-13-21-19(16)14-17/h1-3,5-7,9,11-14,18H,4,8,10,20H2
InChIKeyXEMKRFCQARMVHF-UHFFFAOYSA-N
XLogP4.26
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine
CID 105172695
1-naphthalen-2-yl-4-phenylbutan-1-amine
CID 63416758
4-phenyl-1-quinolin-6-ylbutan-1-ol
CID 63097205
(1R)-1,4-diphenylbutan-1-amine
CID 7131342
2-propan-2-ylsulfanyl-1-quinolin-7-ylethanamine
CID 81231763
3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-ol
CID 105118985
1-isoquinolin-1-yl-4-phenylbutan-1-amine
CID 63950465
3-phenoxy-1-quinolin-6-ylpropan-1-amine
CID 78924724
pyrimidin-2-yl(quinolin-7-yl)methanamine
CID 81220998
1-(4-methylphenyl)-4-phenylbutan-1-amine
CID 62608343
pyridin-2-yl(quinolin-7-yl)methanamine
CID 81220993
5-methyl-1-quinolin-6-ylhexan-1-amine
CID 83161358

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1-quinolin-7-ylbutan-1-amine?
The IUPAC name of 4-phenyl-1-quinolin-7-ylbutan-1-amine (CID 105172595) is 4-phenyl-1-quinolin-7-ylbutan-1-amine.
What is the SMILES notation for 4-phenyl-1-quinolin-7-ylbutan-1-amine?
The canonical SMILES for 4-phenyl-1-quinolin-7-ylbutan-1-amine is NC(CCCc1ccccc1)c1ccc2cccnc2c1.
What is the InChIKey of 4-phenyl-1-quinolin-7-ylbutan-1-amine?
The InChIKey is XEMKRFCQARMVHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c20-18(10-4-8-15-6-2-1-3-7-15)17-12-11-16-9-5-13-21-19(16)14-17/h1-3,5-7,9,11-14,18H,4,8,10,20H2.
What are the key properties of 4-phenyl-1-quinolin-7-ylbutan-1-amine?
4-phenyl-1-quinolin-7-ylbutan-1-amine has a molecular weight of 276.38 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-quinolin-7-ylbutan-1-amine is sourced from PubChem (CID 105172595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).