4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine

C12H20N2O — CID 79496315

IUPAC4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(NCc2ccon2)CC1
InChIInChI=1S/C12H20N2O/c1-2-10-3-5-11(6-4-10)13-9-12-7-8-15-14-12/h7-8,10-11,13H,2-6,9H2,1H3
InChIKeyJNFGUQGKYMESHT-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.73
Rot. Bonds4

About 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine

4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine (PubChem CID 79496315) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine
PubChem CID79496315
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(NCc2ccon2)CC1
InChIInChI=1S/C12H20N2O/c1-2-10-3-5-11(6-4-10)13-9-12-7-8-15-14-12/h7-8,10-11,13H,2-6,9H2,1H3
InChIKeyJNFGUQGKYMESHT-UHFFFAOYSA-N
XLogP2.73
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,2-oxazol-3-ylmethyl)-4-propylcyclohexan-1-amine
CID 79496112
N-(1,2-oxazol-3-ylmethyl)thian-4-amine
CID 79496113
N-(1,2-oxazol-3-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 81171188
N-(1,2-oxazol-3-ylmethyl)-1,1-dioxothian-4-amine
CID 81171423
4,4-dimethyl-N-(1,2-oxazol-3-ylmethyl)cycloheptan-1-amine
CID 81169980
N-(1,2-oxazol-3-ylmethyl)-3-propan-2-ylcyclobutan-1-amine
CID 103562122
2,4-dimethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine
CID 81170767
4-ethyl-N-(pyrimidin-5-ylmethyl)cyclohexan-1-amine
CID 62758802
N-[[2-(4-ethylcyclohexyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 65391135
1-cyclopropyl-N-(1,2-oxazol-3-ylmethyl)pyrrolidin-3-amine
CID 81170847
2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine
CID 62288523
4-ethyl-N-[(4-methylphenyl)methyl]cyclohexan-1-amine
CID 43078853

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine (CID 79496315) is 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine is CCC1CCC(NCc2ccon2)CC1.
What is the InChIKey of 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine?
The InChIKey is JNFGUQGKYMESHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-2-10-3-5-11(6-4-10)13-9-12-7-8-15-14-12/h7-8,10-11,13H,2-6,9H2,1H3.
What are the key properties of 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine?
4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine has a molecular weight of 208.30 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 79496315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).