4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one

C19H24N4O — CID 11301775

IUPAC4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one
SMILESCCCN1Cc2c(N3CCN(C)CC3)nc3ccccc3c2C1=O
InChIInChI=1S/C19H24N4O/c1-3-8-23-13-15-17(19(23)24)14-6-4-5-7-16(14)20-18(15)22-11-9-21(2)10-12-22/h4-7H,3,8-13H2,1-2H3
InChIKeyBSFUWPZJRYENIV-UHFFFAOYSA-N
MW324.43 g/mol
LogP2.35
Rot. Bonds3

About 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one

4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one (PubChem CID 11301775) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one.

Molecular Properties

Compound Name4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one
PubChem CID11301775
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one
SMILESCCCN1Cc2c(N3CCN(C)CC3)nc3ccccc3c2C1=O
InChIInChI=1S/C19H24N4O/c1-3-8-23-13-15-17(19(23)24)14-6-4-5-7-16(14)20-18(15)22-11-9-21(2)10-12-22/h4-7H,3,8-13H2,1-2H3
InChIKeyBSFUWPZJRYENIV-UHFFFAOYSA-N
XLogP2.35
TPSA39.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one?
The IUPAC name of 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one (CID 11301775) is 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one.
What is the SMILES notation for 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one?
The canonical SMILES for 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one is CCCN1Cc2c(N3CCN(C)CC3)nc3ccccc3c2C1=O.
What is the InChIKey of 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one?
The InChIKey is BSFUWPZJRYENIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-3-8-23-13-15-17(19(23)24)14-6-4-5-7-16(14)20-18(15)22-11-9-21(2)10-12-22/h4-7H,3,8-13H2,1-2H3.
What are the key properties of 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one?
4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one has a molecular weight of 324.43 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperazin-1-yl)-2-propyl-3H-pyrrolo[3,4-c]quinolin-1-one is sourced from PubChem (CID 11301775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).