N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine

C13H27NO — CID 155794114

IUPACN,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
SMILESCN(C)C1(COC(C)(C)C)CCCCC1
InChIInChI=1S/C13H27NO/c1-12(2,3)15-11-13(14(4)5)9-7-6-8-10-13/h6-11H2,1-5H3
InChIKeyFIMFSUIRPRHOLT-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.07
Rot. Bonds3

About N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine

N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine (PubChem CID 155794114) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
PubChem CID155794114
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine
SMILESCN(C)C1(COC(C)(C)C)CCCCC1
InChIInChI=1S/C13H27NO/c1-12(2,3)15-11-13(14(4)5)9-7-6-8-10-13/h6-11H2,1-5H3
InChIKeyFIMFSUIRPRHOLT-UHFFFAOYSA-N
XLogP3.07
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[1-(dimethylamino)cyclohexyl]methoxymethyl]-N,N-dimethylcyclohexan-1-amine
CID 67415166
trans-(1S,2R)-N,N-ditert-butyl-2-ethoxy-2-methylcyclohexan-1-amine
CID 71197666
cis-(1R,2R)-N-tert-butyl-2-ethoxy-N-ethyl-2-methylcyclohexan-1-amine
CID 71222393
trans-(1S,2R)-N-tert-butyl-2-ethoxy-N-ethyl-2-methylcyclohexan-1-amine
CID 71222427
1-(1-methoxycyclohexyl)-N,N-dimethylmethanamine
CID 85907451
(S)-N,N-dimethyl-1-(1-oxaspiro[2.5]octan-2-yl)methanamine
CID 118053786
N,N-dimethyl-1-(1-oxaspiro[2.5]octan-2-yl)methanamine
CID 118053793
1-Ethyl-5-methyl-4-oxa-1-azaspiro[5.5]undecane
CID 121013753
N-[(1-methoxycyclohexyl)methyl]-N-methylethanamine
CID 126606567
4-Propan-2-yl-1-oxa-4-azaspiro[5.5]undecane
CID 127377825
1-(2-ethyloxan-2-yl)-N,N-dimethylmethanamine
CID 144689023
1-[1-(Ethoxymethyl)cyclohexyl]azetidine
CID 151253955

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine?
The IUPAC name of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine (CID 155794114) is N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine is CN(C)C1(COC(C)(C)C)CCCCC1.
What is the InChIKey of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine?
The InChIKey is FIMFSUIRPRHOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-12(2,3)15-11-13(14(4)5)9-7-6-8-10-13/h6-11H2,1-5H3.
What are the key properties of N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine?
N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(2-methylpropan-2-yl)oxymethyl]cyclohexan-1-amine is sourced from PubChem (CID 155794114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).