4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide

C14H29N3O — CID 63053485

IUPAC4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide
SMILESCCCNC(CCN1CCCC(C)C1C)C(N)=O
InChIInChI=1S/C14H29N3O/c1-4-8-16-13(14(15)18)7-10-17-9-5-6-11(2)12(17)3/h11-13,16H,4-10H2,1-3H3,(H2,15,18)
InChIKeyFVOYZBBQYYBXBC-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds7

About 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide

4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide (PubChem CID 63053485) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide.

Molecular Properties

Compound Name4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide
PubChem CID63053485
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide
SMILESCCCNC(CCN1CCCC(C)C1C)C(N)=O
InChIInChI=1S/C14H29N3O/c1-4-8-16-13(14(15)18)7-10-17-9-5-6-11(2)12(17)3/h11-13,16H,4-10H2,1-3H3,(H2,15,18)
InChIKeyFVOYZBBQYYBXBC-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide 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

4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanenitrile
CID 63028152
methyl 4-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-(propylamino)butanoate
CID 65324539
methyl 4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-(propylamino)butanoate
CID 63054403
4-[3-(methoxymethyl)piperidin-1-yl]-2-(propylamino)butanamide
CID 106588626
methyl 4-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-(propylamino)butanoate
CID 63055230
4-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-2-(propylamino)butanamide
CID 81199567
4-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(propylamino)butanamide
CID 83221430
4-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-2-(ethylamino)butanamide
CID 63055063
4-(2,5-dioxopyrrolidin-1-yl)-2-(propylamino)butanamide
CID 63041647
4-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-(methylamino)butanamide
CID 63053002
2-(propylamino)-4-pyrazol-1-ylbutanamide
CID 63039561
4-cyclobutyloxy-2-(propylamino)butanamide
CID 63035850

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide?
The IUPAC name of 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide (CID 63053485) is 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide.
What is the SMILES notation for 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide?
The canonical SMILES for 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide is CCCNC(CCN1CCCC(C)C1C)C(N)=O.
What is the InChIKey of 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide?
The InChIKey is FVOYZBBQYYBXBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-4-8-16-13(14(15)18)7-10-17-9-5-6-11(2)12(17)3/h11-13,16H,4-10H2,1-3H3,(H2,15,18).
What are the key properties of 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide?
4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylpiperidin-1-yl)-2-(propylamino)butanamide is sourced from PubChem (CID 63053485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).