N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine

C14H24N2O — CID 104926931

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine
SMILESCCc1cnc(CNC2CCC(C)CC2C)o1
InChIInChI=1S/C14H24N2O/c1-4-12-8-16-14(17-12)9-15-13-6-5-10(2)7-11(13)3/h8,10-11,13,15H,4-7,9H2,1-3H3
InChIKeyIFTVSICOTZKJHZ-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.15
Rot. Bonds4

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine (PubChem CID 104926931) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine
PubChem CID104926931
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine
SMILESCCc1cnc(CNC2CCC(C)CC2C)o1
InChIInChI=1S/C14H24N2O/c1-4-12-8-16-14(17-12)9-15-13-6-5-10(2)7-11(13)3/h8,10-11,13,15H,4-7,9H2,1-3H3
InChIKeyIFTVSICOTZKJHZ-UHFFFAOYSA-N
XLogP3.15
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,6-dimethylcyclohexan-1-amine
CID 113428820
N-[(5-ethylthiophen-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine
CID 63996436
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylpropan-2-amine
CID 65184221
2,4-dimethyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclohexan-1-amine
CID 64761102
2,4-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]cyclohexan-1-amine
CID 80709898
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
CID 104926902
5-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propan-2-ylcyclohexan-1-amine
CID 104577704
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,2-dimethyloxan-4-amine
CID 106369246
2,4-dimethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine
CID 81170767
3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]pyrrolidine-2,5-dione
CID 106370763
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,6-dioxaspiro[4.5]decan-9-amine
CID 106370958
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butan-1-amine
CID 106369292

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine (CID 104926931) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine is CCc1cnc(CNC2CCC(C)CC2C)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine?
The InChIKey is IFTVSICOTZKJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-12-8-16-14(17-12)9-15-13-6-5-10(2)7-11(13)3/h8,10-11,13,15H,4-7,9H2,1-3H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine has a molecular weight of 236.36 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2,4-dimethylcyclohexan-1-amine is sourced from PubChem (CID 104926931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).