3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide

C17H28N4O — CID 118768572

IUPAC3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide
SMILESCCC(NC(=O)CCN1CCN(C)CC1)c1ncccc1C
InChIInChI=1S/C17H28N4O/c1-4-15(17-14(2)6-5-8-18-17)19-16(22)7-9-21-12-10-20(3)11-13-21/h5-6,8,15H,4,7,9-13H2,1-3H3,(H,19,22)
InChIKeyOCHXWYGPVZDIPN-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.59
Rot. Bonds6

About 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide

3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide (PubChem CID 118768572) has the molecular formula C17H28N4O and a molecular weight of 304.44 g/mol. Its IUPAC name is 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide.

Molecular Properties

Compound Name3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide
PubChem CID118768572
Molecular FormulaC17H28N4O
Molecular Weight304.44 g/mol
Exact Mass304.23
IUPAC Name3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide
SMILESCCC(NC(=O)CCN1CCN(C)CC1)c1ncccc1C
InChIInChI=1S/C17H28N4O/c1-4-15(17-14(2)6-5-8-18-17)19-16(22)7-9-21-12-10-20(3)11-13-21/h5-6,8,15H,4,7,9-13H2,1-3H3,(H,19,22)
InChIKeyOCHXWYGPVZDIPN-UHFFFAOYSA-N
XLogP1.59
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide 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

2-(4-methyl-1,4-diazepan-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]acetamide
CID 91765215
3-(2-methyl-6-oxo-1-pyridinyl)-N-[(1S)-1-(3-methyl-2-pyridinyl)propyl]propanamide
CID 126441957
N-[1-(3-methyl-2-pyridinyl)propyl]-4-pyrrolidin-1-ylbenzamide
CID 91761816
2-[2-methoxyethyl(methyl)amino]-N-[(1R)-1-(3-methyl-2-pyridinyl)propyl]acetamide
CID 125443954
N-[(2-methylphenyl)-pyridin-4-ylmethyl]-3-(4-methylpiperazin-1-yl)propanamide
CID 118789936
N-[(1R)-1,2-diphenylethyl]-3-(4-methylpiperazin-1-yl)propanamide
CID 125175804
N-[(S)-cyclopropyl-(3-methyl-2-pyridinyl)methyl]-4-pyrazol-1-ylbutanamide
CID 125160409
1,6-dimethyl-N-[1-(3-methyl-2-pyridinyl)propyl]-4-oxopyridine-3-carboxamide
CID 118773094
3-(4-methylpiperazin-1-yl)-N-[1-(5-methyl-2-pyridinyl)ethyl]propanamide
CID 91788298
2-ethyl-4-methyl-N-[(1R)-1-(3-methyl-2-pyridinyl)propyl]-1,3-oxazole-5-carboxamide
CID 125447047
2-ethyl-4-methyl-N-[1-(3-methyl-2-pyridinyl)propyl]-1,3-oxazole-5-carboxamide
CID 122570843
4-chloro-5-methyl-N-[(1S)-1-(3-methyl-2-pyridinyl)propyl]-1H-pyrazole-3-carboxamide
CID 125446765

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide?
The IUPAC name of 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide (CID 118768572) is 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide.
What is the SMILES notation for 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide?
The canonical SMILES for 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide is CCC(NC(=O)CCN1CCN(C)CC1)c1ncccc1C.
What is the InChIKey of 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide?
The InChIKey is OCHXWYGPVZDIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O/c1-4-15(17-14(2)6-5-8-18-17)19-16(22)7-9-21-12-10-20(3)11-13-21/h5-6,8,15H,4,7,9-13H2,1-3H3,(H,19,22).
What are the key properties of 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide?
3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide has a molecular weight of 304.44 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylpiperazin-1-yl)-N-[1-(3-methyl-2-pyridinyl)propyl]propanamide is sourced from PubChem (CID 118768572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).