N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide

C19H24N2O2 — CID 71839867

IUPACN-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
SMILESO=C(CCc1conc1-c1ccccc1)NCC1CCCCC1
InChIInChI=1S/C19H24N2O2/c22-18(20-13-15-7-3-1-4-8-15)12-11-17-14-23-21-19(17)16-9-5-2-6-10-16/h2,5-6,9-10,14-15H,1,3-4,7-8,11-13H2,(H,20,22)
InChIKeyDBQAQHKVCCFCBU-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.97
Rot. Bonds6

About N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide

N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide (PubChem CID 71839867) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
PubChem CID71839867
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
SMILESO=C(CCc1conc1-c1ccccc1)NCC1CCCCC1
InChIInChI=1S/C19H24N2O2/c22-18(20-13-15-7-3-1-4-8-15)12-11-17-14-23-21-19(17)16-9-5-2-6-10-16/h2,5-6,9-10,14-15H,1,3-4,7-8,11-13H2,(H,20,22)
InChIKeyDBQAQHKVCCFCBU-UHFFFAOYSA-N
XLogP3.97
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide
CID 53161791
N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide
CID 95899940
N-(cycloheptylmethyl)-2-phenylacetamide
CID 54313529
N-(cyclopropylmethyl)-3-phenylpropanamide
CID 51076426
1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-(3-phenyl-1,2-oxazol-4-yl)propan-1-one
CID 71839863
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-phenylacetate
CID 55319435
N-(cyclohexylmethyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 24679617
3-[3-(4-methylphenyl)-1,2-oxazol-4-yl]-N-(thiophen-2-ylmethyl)propanamide
CID 71839823
3-[2-amino-6-(2-methoxyphenyl)quinolin-3-yl]-N-(cyclohexylmethyl)propanamide
CID 118970656
N-(cyclopentylmethyl)-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110627595
3-(1-methyl-3-phenylpyrazol-4-yl)-N-[[(2S)-oxolan-2-yl]methyl]propanamide
CID 95065889
3-(4-aminophenyl)-N-(cyclopentylmethyl)propanamide
CID 43371351

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide?
The IUPAC name of N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide (CID 71839867) is N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide.
What is the SMILES notation for N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide?
The canonical SMILES for N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide is O=C(CCc1conc1-c1ccccc1)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide?
The InChIKey is DBQAQHKVCCFCBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c22-18(20-13-15-7-3-1-4-8-15)12-11-17-14-23-21-19(17)16-9-5-2-6-10-16/h2,5-6,9-10,14-15H,1,3-4,7-8,11-13H2,(H,20,22).
What are the key properties of N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide?
N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide is sourced from PubChem (CID 71839867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).