1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine

C14H29NO — CID 105154410

IUPAC1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine
SMILESCNC(COC(C)C)C1CCC(C)C(C)C1
InChIInChI=1S/C14H29NO/c1-10(2)16-9-14(15-5)13-7-6-11(3)12(4)8-13/h10-15H,6-9H2,1-5H3
InChIKeyYEZBNGCVFHZLCS-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.07
Rot. Bonds5

About 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine

1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine (PubChem CID 105154410) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine.

Molecular Properties

Compound Name1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine
PubChem CID105154410
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine
SMILESCNC(COC(C)C)C1CCC(C)C(C)C1
InChIInChI=1S/C14H29NO/c1-10(2)16-9-14(15-5)13-7-6-11(3)12(4)8-13/h10-15H,6-9H2,1-5H3
InChIKeyYEZBNGCVFHZLCS-UHFFFAOYSA-N
XLogP3.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylcyclohexyl)-4-methoxy-N,3-dimethylbutan-1-amine
CID 105154616
3-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-methylpropan-1-amine
CID 104989179
1-(3,4-dimethylcyclohexyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103559423
1-(3,4-dimethylcyclohexyl)-2-(4-fluorophenyl)-N-methylethanamine
CID 64739642
(1-cyclopropyl-2-propan-2-yloxyethyl)hydrazine
CID 105202587
[1-(3-methylcyclohexyl)-2-propan-2-yloxyethyl]hydrazine
CID 105210429
[2-cyclopropyl-1-(3,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105254136
[1-(3-ethylcyclopentyl)-2-propan-2-yloxyethyl]hydrazine
CID 105233671
2-cyclohexyl-1-(3,4-dimethylcyclohexyl)-N-ethylethanamine
CID 104989257
[1-(3,4-dimethylcyclohexyl)-3-methoxypropyl]hydrazine
CID 105206434
2-(2,4-difluorophenyl)-1-(3,4-dimethylcyclohexyl)-N-methylethanamine
CID 64740451
1-cyclobutyl-1-(3,4-dimethylcyclohexyl)-N-methylmethanamine
CID 64986980

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine?
The IUPAC name of 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine (CID 105154410) is 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine.
What is the SMILES notation for 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine?
The canonical SMILES for 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine is CNC(COC(C)C)C1CCC(C)C(C)C1.
What is the InChIKey of 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine?
The InChIKey is YEZBNGCVFHZLCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-10(2)16-9-14(15-5)13-7-6-11(3)12(4)8-13/h10-15H,6-9H2,1-5H3.
What are the key properties of 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine?
1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine has a molecular weight of 227.39 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylcyclohexyl)-N-methyl-2-propan-2-yloxyethanamine is sourced from PubChem (CID 105154410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).