N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide

C14H26N2O — CID 113343495

IUPACN-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide
SMILESC=CCCCN(C)C(=O)CCC1CCNCC1
InChIInChI=1S/C14H26N2O/c1-3-4-5-12-16(2)14(17)7-6-13-8-10-15-11-9-13/h3,13,15H,1,4-12H2,2H3
InChIKeyBAGRAJIHSFHXCJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.19
Rot. Bonds7

About N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide

N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide (PubChem CID 113343495) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide
PubChem CID113343495
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide
SMILESC=CCCCN(C)C(=O)CCC1CCNCC1
InChIInChI=1S/C14H26N2O/c1-3-4-5-12-16(2)14(17)7-6-13-8-10-15-11-9-13/h3,13,15H,1,4-12H2,2H3
InChIKeyBAGRAJIHSFHXCJ-UHFFFAOYSA-N
XLogP2.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide 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

N-[2-(dimethylamino)ethyl]-N-methyl-3-piperidin-4-ylpropanamide
CID 55227726
N-methyl-N-pent-4-enylpiperidine-4-carboxamide;hydrochloride
CID 119330191
N-methyl-N-pent-4-enyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119795382
2-[methyl(3-piperidin-4-ylpropanoyl)amino]acetic acid
CID 62212379
N-(cyclobutylmethyl)-N-methyl-3-piperidin-4-ylpropanamide
CID 62860278
4-amino-N,4-dimethyl-N-pent-4-enylpentanamide
CID 115740355
N-methyl-N-(piperidin-4-ylmethyl)pent-4-en-1-amine
CID 79716294
N-methyl-N-pent-4-enylpropanamide
CID 115640317
N-methyl-3-piperidin-4-yl-N-propan-2-ylpropanamide
CID 62211368
4-[methyl(undec-10-enoyl)amino]butanoic acid
CID 10016696
N-[3-(dimethylamino)propyl]-N-methyl-2-piperidin-4-ylacetamide
CID 63693325
N-butyl-N-methyl-2-piperidin-4-ylacetamide
CID 24710322

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide?
The IUPAC name of N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide (CID 113343495) is N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide is C=CCCCN(C)C(=O)CCC1CCNCC1.
What is the InChIKey of N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide?
The InChIKey is BAGRAJIHSFHXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-4-5-12-16(2)14(17)7-6-13-8-10-15-11-9-13/h3,13,15H,1,4-12H2,2H3.
What are the key properties of N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide?
N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide has a molecular weight of 238.37 g/mol, XLogP of 2.19, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 113343495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).