4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline

C18H24N2O — CID 107448333

IUPAC4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline
SMILESCC(C)C1CCCC(Nc2ccc(-c3cnco3)cc2)C1
InChIInChI=1S/C18H24N2O/c1-13(2)15-4-3-5-17(10-15)20-16-8-6-14(7-9-16)18-11-19-12-21-18/h6-9,11-13,15,17,20H,3-5,10H2,1-2H3
InChIKeyYWWYBYBMPUNEMF-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.97
Rot. Bonds4

About 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline

4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline (PubChem CID 107448333) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline.

Molecular Properties

Compound Name4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline
PubChem CID107448333
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline
SMILESCC(C)C1CCCC(Nc2ccc(-c3cnco3)cc2)C1
InChIInChI=1S/C18H24N2O/c1-13(2)15-4-3-5-17(10-15)20-16-8-6-14(7-9-16)18-11-19-12-21-18/h6-9,11-13,15,17,20H,3-5,10H2,1-2H3
InChIKeyYWWYBYBMPUNEMF-UHFFFAOYSA-N
XLogP4.97
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyclopropylcyclohexyl)-4-(1,3-oxazol-5-yl)aniline
CID 64623155
N-(3-methylcyclobutyl)-4-(1,3-oxazol-5-yl)aniline
CID 104860103
1-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]piperidin-4-amine
CID 54864429
5-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]thiolan-3-amine
CID 79942657
2-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]thian-3-amine
CID 79957578
N-(3-methylbutan-2-yl)-4-(1,3-oxazol-5-yl)aniline
CID 54864396
N-(3-propan-2-ylcyclohexyl)-1H-indazol-6-amine
CID 107448253
1-methyl-3-[4-(1,3-oxazol-5-yl)anilino]pyrrolidine-2,5-dione
CID 60934102
N-(3-propan-2-ylcyclohexyl)-2,3-dihydro-1H-inden-5-amine
CID 107447796
3,5-dimethyl-N-(3-propan-2-ylcyclohexyl)aniline
CID 107447823
3,5-difluoro-N-(3-propan-2-ylcyclohexyl)aniline
CID 107447829
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-4-(1,3-oxazol-5-yl)benzamide
CID 167815020

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline?
The IUPAC name of 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline (CID 107448333) is 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline.
What is the SMILES notation for 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline?
The canonical SMILES for 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline is CC(C)C1CCCC(Nc2ccc(-c3cnco3)cc2)C1.
What is the InChIKey of 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline?
The InChIKey is YWWYBYBMPUNEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13(2)15-4-3-5-17(10-15)20-16-8-6-14(7-9-16)18-11-19-12-21-18/h6-9,11-13,15,17,20H,3-5,10H2,1-2H3.
What are the key properties of 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline?
4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline has a molecular weight of 284.40 g/mol, XLogP of 4.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-oxazol-5-yl)-N-(3-propan-2-ylcyclohexyl)aniline is sourced from PubChem (CID 107448333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).