6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine

C18H17N3 — CID 648749

IUPAC6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine
SMILESCc1ccc2nc3c(c(N)c2c1)CCN3c1ccccc1
InChIInChI=1S/C18H17N3/c1-12-7-8-16-15(11-12)17(19)14-9-10-21(18(14)20-16)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H2,19,20)
InChIKeyRMFDFWIUWQZPBH-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.82
Rot. Bonds1

About 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine

6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine (PubChem CID 648749) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine.

Molecular Properties

Compound Name6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine
PubChem CID648749
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine
SMILESCc1ccc2nc3c(c(N)c2c1)CCN3c1ccccc1
InChIInChI=1S/C18H17N3/c1-12-7-8-16-15(11-12)17(19)14-9-10-21(18(14)20-16)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H2,19,20)
InChIKeyRMFDFWIUWQZPBH-UHFFFAOYSA-N
XLogP3.82
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine?
The IUPAC name of 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine (CID 648749) is 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine.
What is the SMILES notation for 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine?
The canonical SMILES for 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine is Cc1ccc2nc3c(c(N)c2c1)CCN3c1ccccc1.
What is the InChIKey of 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine?
The InChIKey is RMFDFWIUWQZPBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-12-7-8-16-15(11-12)17(19)14-9-10-21(18(14)20-16)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H2,19,20).
What are the key properties of 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine?
6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine has a molecular weight of 275.36 g/mol, XLogP of 3.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-phenyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine is sourced from PubChem (CID 648749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).