5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide

C11H18N2O2 — CID 118669200

IUPAC5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)NCCCC(C)C
InChIInChI=1S/C11H18N2O2/c1-8(2)5-4-6-12-11(14)10-9(3)15-7-13-10/h7-8H,4-6H2,1-3H3,(H,12,14)
InChIKeyHZWQFZANUGKPAB-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.15
Rot. Bonds5

About 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide

5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide (PubChem CID 118669200) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide
PubChem CID118669200
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)NCCCC(C)C
InChIInChI=1S/C11H18N2O2/c1-8(2)5-4-6-12-11(14)10-9(3)15-7-13-10/h7-8H,4-6H2,1-3H3,(H,12,14)
InChIKeyHZWQFZANUGKPAB-UHFFFAOYSA-N
XLogP2.15
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-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

N-cyclopentyl-2,5-dimethyl-1,3-oxazole-4-carboxamide
CID 53195138
N-[rel-(3R,4S)-1-(cyclobutylmethyl)-4-isopropyl-3-pyrrolidinyl]-5-methyl-1,3-oxazole-4-carboxamide hydrochloride
CID 72918063
N-cyclohexyl-2,5-dimethyl-1,3-oxazole-4-carboxamide
CID 53195128
N-(cyclohexylmethyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide
CID 53195171
5-methyl-N-(oxolan-2-ylmethyl)-2-propan-2-yl-1,3-oxazole-4-carboxamide
CID 53195191
N-Cyclohexyl-5-methyl-2-(propan-2-YL)-1,3-oxazole-4-carboxamide
CID 53195198
N-{2-[cyclohexyl(methyl)amino]ethyl}-2,5-dimethyl-1,3-oxazole-4-carboxamide
CID 53195185
5-Methyl-N-[3-(morpholin-4-YL)propyl]-2-(propan-2-YL)-1,3-oxazole-4-carboxamide
CID 53195190
2,2-dimethyl-N-({5-methyl-4-[(4-methylpiperidino)carbonyl]-1,3-oxazol-2-yl}methyl)propanamide
CID 53195520
2-{[(2,2-dimethylpropanoyl)amino]methyl}-N~4~,N~4~-diethyl-5-methyl-1,3-oxazole-4-carboxamide
CID 53195614
1-[(5-Methyl-1,3-oxazol-4-yl)carbonyl]-4-(1-pyrrolidinylcarbonyl)piperidine
CID 70758906
N-Cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 74234028

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide (CID 118669200) is 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide is Cc1ocnc1C(=O)NCCCC(C)C.
What is the InChIKey of 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide?
The InChIKey is HZWQFZANUGKPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-8(2)5-4-6-12-11(14)10-9(3)15-7-13-10/h7-8H,4-6H2,1-3H3,(H,12,14).
What are the key properties of 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide?
5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-methylpentyl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 118669200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).