3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide

C12H25N3O — CID 114515725

IUPAC3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
SMILESCNCCC(=O)NCCC1CCN(C)CC1
InChIInChI=1S/C12H25N3O/c1-13-7-4-12(16)14-8-3-11-5-9-15(2)10-6-11/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyCYFPNGIQQJSNLA-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.44
Rot. Bonds6

About 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide

3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide (PubChem CID 114515725) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
PubChem CID114515725
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
SMILESCNCCC(=O)NCCC1CCN(C)CC1
InChIInChI=1S/C12H25N3O/c1-13-7-4-12(16)14-8-3-11-5-9-15(2)10-6-11/h11,13H,3-10H2,1-2H3,(H,14,16)
InChIKeyCYFPNGIQQJSNLA-UHFFFAOYSA-N
XLogP0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]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

3-(tert-butylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 114515771
N-[2-(1-methylpiperidin-4-yl)ethyl]-3-(propan-2-ylamino)propanamide
CID 113267480
4-amino-4-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]pentanamide
CID 115740935
4-amino-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide;dihydrochloride
CID 119865945
3-amino-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 115740928
4-[2-(1-methylpyrrolidin-3-yl)ethylamino]-4-oxobutanoic acid
CID 115163740
ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 145305078
N-[2-(dimethylamino)ethyl]-3-(1-methylpiperidin-4-yl)propanamide
CID 20719712
N-[2-(1-methylpiperidin-4-yl)ethyl]-3-piperidin-3-ylpropanamide
CID 114515740
1-[2-[2-(1-methylpiperidin-4-yl)ethylamino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 114515072
N-methyl-2-[2-(1-methylpiperidin-4-yl)ethylamino]acetamide
CID 114515397
3-[(1-methylpiperidin-4-yl)methylamino]-N-propylpropanamide
CID 62659463

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide?
The IUPAC name of 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide (CID 114515725) is 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide.
What is the SMILES notation for 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide?
The canonical SMILES for 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide is CNCCC(=O)NCCC1CCN(C)CC1.
What is the InChIKey of 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide?
The InChIKey is CYFPNGIQQJSNLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-13-7-4-12(16)14-8-3-11-5-9-15(2)10-6-11/h11,13H,3-10H2,1-2H3,(H,14,16).
What are the key properties of 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide?
3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide has a molecular weight of 227.35 g/mol, XLogP of 0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide is sourced from PubChem (CID 114515725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).