1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one

C24H34N4O — CID 42879930

IUPAC1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one
SMILESCCN1CCN(C(=O)CC(c2ccccc2C)c2cnc3n2CCCC3C)CC1
InChIInChI=1S/C24H34N4O/c1-4-26-12-14-27(15-13-26)23(29)16-21(20-10-6-5-8-18(20)2)22-17-25-24-19(3)9-7-11-28(22)24/h5-6,8,10,17,19,21H,4,7,9,11-16H2,1-3H3
InChIKeyMVHLMUXNQRMWRG-UHFFFAOYSA-N
MW394.56 g/mol
LogP3.77
Rot. Bonds5

About 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one

1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one (PubChem CID 42879930) has the molecular formula C24H34N4O and a molecular weight of 394.56 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one.

Molecular Properties

Compound Name1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one
PubChem CID42879930
Molecular FormulaC24H34N4O
Molecular Weight394.56 g/mol
Exact Mass394.27
IUPAC Name1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one
SMILESCCN1CCN(C(=O)CC(c2ccccc2C)c2cnc3n2CCCC3C)CC1
InChIInChI=1S/C24H34N4O/c1-4-26-12-14-27(15-13-26)23(29)16-21(20-10-6-5-8-18(20)2)22-17-25-24-19(3)9-7-11-28(22)24/h5-6,8,10,17,19,21H,4,7,9,11-16H2,1-3H3
InChIKeyMVHLMUXNQRMWRG-UHFFFAOYSA-N
XLogP3.77
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.56
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R)-N-benzyl-3-(2-methylphenyl)-3-[(8R)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]propanamide
CID 93019360
(3S)-N-(furan-2-ylmethyl)-3-(2-methylphenyl)-3-[(8S)-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]propanamide
CID 93019363
1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-pyrrol-1-ylpropan-1-one
CID 46342958
1-(4-ethylpiperazin-1-yl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-phenylpropan-1-one
CID 4695381
(3R)-1-(4-hydroxypiperidin-1-yl)-3-(2-methylphenyl)-3-phenylpropan-1-one
CID 25279572
1-(4-benzylpiperidin-1-yl)-3-(8-methylimidazo[1,2-a]pyridin-3-yl)-3-(2-methylphenyl)propan-1-one
CID 4277904
1-[4-[(4-tert-butylpiperazin-1-yl)methyl]piperidin-1-yl]-3,3-bis(2-methylphenyl)propan-1-one
CID 24794732
3-(1-ethylpiperidin-4-yl)-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117152479
(3R)-1-[4-(methoxymethyl)piperidin-1-yl]-3-(2-methylphenyl)-3-phenylpropan-1-one
CID 42245855
3-(2-methylphenyl)-1-piperidin-1-ylbutan-1-one
CID 71930972
N-benzyl-N-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-5-methylpyrazine-2-carboxamide
CID 1026347
N-[1-[3-(2-methylphenyl)-3-phenylpropanoyl]piperidin-4-yl]methanesulfonamide
CID 72877580

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one?
The IUPAC name of 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one (CID 42879930) is 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one.
What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one?
The canonical SMILES for 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one is CCN1CCN(C(=O)CC(c2ccccc2C)c2cnc3n2CCCC3C)CC1.
What is the InChIKey of 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one?
The InChIKey is MVHLMUXNQRMWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34N4O/c1-4-26-12-14-27(15-13-26)23(29)16-21(20-10-6-5-8-18(20)2)22-17-25-24-19(3)9-7-11-28(22)24/h5-6,8,10,17,19,21H,4,7,9,11-16H2,1-3H3.
What are the key properties of 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one?
1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one has a molecular weight of 394.56 g/mol, XLogP of 3.77, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)-3-(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)propan-1-one is sourced from PubChem (CID 42879930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).