3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine

C15H26N2O — CID 112682066

IUPAC3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine
SMILESCc1cc(CNC2CC(C)(C)CC(C)(C)C2)no1
InChIInChI=1S/C15H26N2O/c1-11-6-12(17-18-11)9-16-13-7-14(2,3)10-15(4,5)8-13/h6,13,16H,7-10H2,1-5H3
InChIKeyPQHSUUITVDQODY-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.68
Rot. Bonds3

About 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine

3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine (PubChem CID 112682066) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine
PubChem CID112682066
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine
SMILESCc1cc(CNC2CC(C)(C)CC(C)(C)C2)no1
InChIInChI=1S/C15H26N2O/c1-11-6-12(17-18-11)9-16-13-7-14(2,3)10-15(4,5)8-13/h6,13,16H,7-10H2,1-5H3
InChIKeyPQHSUUITVDQODY-UHFFFAOYSA-N
XLogP3.68
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclobutane-1,3-diamine
CID 80560659
1-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-amine
CID 60694528
1-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]azepan-4-amine
CID 65070599
(5-methyl-1,2-oxazol-3-yl)methylhydrazine
CID 66157923
N-[(4-fluorophenyl)methyl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 112681857
2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclopentan-1-amine
CID 65045485
3,3,5,5-tetramethyl-N-(1,3-oxazol-5-ylmethyl)cyclohexan-1-amine
CID 113359579
2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]oxolan-3-amine
CID 115336384
2,2-dimethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1,3-dihydroinden-1-amine
CID 82821354
2,2-dimethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3H-1-benzofuran-3-amine
CID 106701083
2-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propan-1-amine
CID 60686114
N-[[4-(methoxymethyl)phenyl]methyl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 103965630

Frequently Asked Questions

What is the IUPAC name of 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine (CID 112682066) is 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine is Cc1cc(CNC2CC(C)(C)CC(C)(C)C2)no1.
What is the InChIKey of 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine?
The InChIKey is PQHSUUITVDQODY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-11-6-12(17-18-11)9-16-13-7-14(2,3)10-15(4,5)8-13/h6,13,16H,7-10H2,1-5H3.
What are the key properties of 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine?
3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5,5-tetramethyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 112682066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).