N,N-dimethyl-2-tetradecyloxirane-2-carboxamide

C19H37NO2 — CID 12782920

IUPACN,N-dimethyl-2-tetradecyloxirane-2-carboxamide
SMILESCCCCCCCCCCCCCCC1(C(=O)N(C)C)CO1
InChIInChI=1S/C19H37NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17-22-19)18(21)20(2)3/h4-17H2,1-3H3
InChIKeyCFYBGXYYGONFBJ-UHFFFAOYSA-N
MW311.51 g/mol
LogP4.93
Rot. Bonds14

About N,N-dimethyl-2-tetradecyloxirane-2-carboxamide

N,N-dimethyl-2-tetradecyloxirane-2-carboxamide (PubChem CID 12782920) has the molecular formula C19H37NO2 and a molecular weight of 311.51 g/mol. Its IUPAC name is N,N-dimethyl-2-tetradecyloxirane-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-tetradecyloxirane-2-carboxamide
PubChem CID12782920
Molecular FormulaC19H37NO2
Molecular Weight311.51 g/mol
Exact Mass311.28
IUPAC NameN,N-dimethyl-2-tetradecyloxirane-2-carboxamide
SMILESCCCCCCCCCCCCCCC1(C(=O)N(C)C)CO1
InChIInChI=1S/C19H37NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17-22-19)18(21)20(2)3/h4-17H2,1-3H3
InChIKeyCFYBGXYYGONFBJ-UHFFFAOYSA-N
XLogP4.93
TPSA32.84 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.51
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze N,N-dimethyl-2-tetradecyloxirane-2-carboxamide 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-Tetradecyloxirane-2-carboxamide
CID 12782918
(2R,3S)-3-hexadecanoyl-N,N-dimethyloxirane-2-carboxamide
CID 10546023
(2R,3S)-N,N-dimethyl-3-octadecanoyloxirane-2-carboxamide
CID 10619863
(2R,3S)-N,N-dimethyl-3-tetradecanoyloxirane-2-carboxamide
CID 10687539
(2R,3S)-3-dodecyl-N,N-diethyloxirane-2-carboxamide
CID 10638801
(2R,3S)-N,N-diethyl-3-heptyl-2-methyloxirane-2-carboxamide
CID 12135815
2-hexadecyl-N,N-dimethyloxirane-2-carboxamide
CID 20345885
2-Pentadecyloxirane-2-carboxamide
CID 20511390
N-butyl-2-tridecyloxirane-2-carboxamide
CID 20511398
N-ethyl-N-methyl-2-tridecyloxirane-2-carboxamide
CID 20511409
2-Tridecyloxirane-2-carboxamide
CID 20511410
N-methyl-2-octyloxirane-2-carboxamide
CID 20511411

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-tetradecyloxirane-2-carboxamide?
The IUPAC name of N,N-dimethyl-2-tetradecyloxirane-2-carboxamide (CID 12782920) is N,N-dimethyl-2-tetradecyloxirane-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-tetradecyloxirane-2-carboxamide?
The canonical SMILES for N,N-dimethyl-2-tetradecyloxirane-2-carboxamide is CCCCCCCCCCCCCCC1(C(=O)N(C)C)CO1.
What is the InChIKey of N,N-dimethyl-2-tetradecyloxirane-2-carboxamide?
The InChIKey is CFYBGXYYGONFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17-22-19)18(21)20(2)3/h4-17H2,1-3H3.
What are the key properties of N,N-dimethyl-2-tetradecyloxirane-2-carboxamide?
N,N-dimethyl-2-tetradecyloxirane-2-carboxamide has a molecular weight of 311.51 g/mol, XLogP of 4.93, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-tetradecyloxirane-2-carboxamide is sourced from PubChem (CID 12782920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).