4-methyl-2-phenyl-3-propylquinoline

C19H19N — CID 39902639

IUPAC4-methyl-2-phenyl-3-propylquinoline
SMILESCCCc1c(-c2ccccc2)nc2ccccc2c1C
InChIInChI=1S/C19H19N/c1-3-9-17-14(2)16-12-7-8-13-18(16)20-19(17)15-10-5-4-6-11-15/h4-8,10-13H,3,9H2,1-2H3
InChIKeyREZDVZDSISMJSO-UHFFFAOYSA-N
MW261.37 g/mol
LogP5.16
Rot. Bonds3

About 4-methyl-2-phenyl-3-propylquinoline

4-methyl-2-phenyl-3-propylquinoline (PubChem CID 39902639) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-methyl-2-phenyl-3-propylquinoline.

Molecular Properties

Compound Name4-methyl-2-phenyl-3-propylquinoline
PubChem CID39902639
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name4-methyl-2-phenyl-3-propylquinoline
SMILESCCCc1c(-c2ccccc2)nc2ccccc2c1C
InChIInChI=1S/C19H19N/c1-3-9-17-14(2)16-12-7-8-13-18(16)20-19(17)15-10-5-4-6-11-15/h4-8,10-13H,3,9H2,1-2H3
InChIKeyREZDVZDSISMJSO-UHFFFAOYSA-N
XLogP5.16
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500261.37
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-phenyl-3-propyl-1,4-benzodiazepin-2-one
CID 91051065
9-butylacridine
CID 606127
ethyl 4-pentyl-2-phenylquinoline-3-carboxylate
CID 45141730
4-chloro-3-methyl-2-phenyl-6-propylquinoline
CID 104845968
6-(4-methylphenyl)phenanthridine
CID 10707098
2-[2-(4-fluorophenyl)-4-methylquinolin-3-yl]acetic acid
CID 18073377
acridine;9-propylacridine
CID 146450775
4-methyl-2-phenyl-3-phenylsulfanylquinoline
CID 4685647
3,4-diethyl-2-phenyl-5,6-dipropylpyridine
CID 15439664
2-ethyl-4-(4-phenylphenyl)quinazoline
CID 134403599
2,3-diethyl-1-methyl-4-propylnaphthalene
CID 139700920
2-[4-phenyl-2-(4-propylphenyl)quinolin-3-yl]acetate
CID 8966267

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-phenyl-3-propylquinoline?
The IUPAC name of 4-methyl-2-phenyl-3-propylquinoline (CID 39902639) is 4-methyl-2-phenyl-3-propylquinoline.
What is the SMILES notation for 4-methyl-2-phenyl-3-propylquinoline?
The canonical SMILES for 4-methyl-2-phenyl-3-propylquinoline is CCCc1c(-c2ccccc2)nc2ccccc2c1C.
What is the InChIKey of 4-methyl-2-phenyl-3-propylquinoline?
The InChIKey is REZDVZDSISMJSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N/c1-3-9-17-14(2)16-12-7-8-13-18(16)20-19(17)15-10-5-4-6-11-15/h4-8,10-13H,3,9H2,1-2H3.
What are the key properties of 4-methyl-2-phenyl-3-propylquinoline?
4-methyl-2-phenyl-3-propylquinoline has a molecular weight of 261.37 g/mol, XLogP of 5.16, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-phenyl-3-propylquinoline is sourced from PubChem (CID 39902639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).