N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide

C19H24N4O2 — CID 20912782

IUPACN,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide
SMILESCCCn1c2ccccc2c2cnn(CC(=O)N(CC)CC)c(=O)c21
InChIInChI=1S/C19H24N4O2/c1-4-11-22-16-10-8-7-9-14(16)15-12-20-23(19(25)18(15)22)13-17(24)21(5-2)6-3/h7-10,12H,4-6,11,13H2,1-3H3
InChIKeyPYILZXKTZPJETQ-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.63
Rot. Bonds6

About N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide

N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide (PubChem CID 20912782) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide
PubChem CID20912782
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide
SMILESCCCn1c2ccccc2c2cnn(CC(=O)N(CC)CC)c(=O)c21
InChIInChI=1S/C19H24N4O2/c1-4-11-22-16-10-8-7-9-14(16)15-12-20-23(19(25)18(15)22)13-17(24)21(5-2)6-3/h7-10,12H,4-6,11,13H2,1-3H3
InChIKeyPYILZXKTZPJETQ-UHFFFAOYSA-N
XLogP2.63
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide?
The IUPAC name of N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide (CID 20912782) is N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide?
The canonical SMILES for N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide is CCCn1c2ccccc2c2cnn(CC(=O)N(CC)CC)c(=O)c21.
What is the InChIKey of N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide?
The InChIKey is PYILZXKTZPJETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-4-11-22-16-10-8-7-9-14(16)15-12-20-23(19(25)18(15)22)13-17(24)21(5-2)6-3/h7-10,12H,4-6,11,13H2,1-3H3.
What are the key properties of N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide?
N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide has a molecular weight of 340.43 g/mol, XLogP of 2.63, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(4-oxo-5-propylpyridazino[4,5-b]indol-3-yl)acetamide is sourced from PubChem (CID 20912782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).