4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine

C18H38N2O — CID 62610178

IUPAC4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine
SMILESCCNC1CCC(C(C)(C)C)CC1CN(CC)CCOC
InChIInChI=1S/C18H38N2O/c1-7-19-17-10-9-16(18(3,4)5)13-15(17)14-20(8-2)11-12-21-6/h15-17,19H,7-14H2,1-6H3
InChIKeyZUVDMSMTTQBAOM-UHFFFAOYSA-N
MW298.51 g/mol
LogP3.40
Rot. Bonds8

About 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine

4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 62610178) has the molecular formula C18H38N2O and a molecular weight of 298.51 g/mol. Its IUPAC name is 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine
PubChem CID62610178
Molecular FormulaC18H38N2O
Molecular Weight298.51 g/mol
Exact Mass298.30
IUPAC Name4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine
SMILESCCNC1CCC(C(C)(C)C)CC1CN(CC)CCOC
InChIInChI=1S/C18H38N2O/c1-7-19-17-10-9-16(18(3,4)5)13-15(17)14-20(8-2)11-12-21-6/h15-17,19H,7-14H2,1-6H3
InChIKeyZUVDMSMTTQBAOM-UHFFFAOYSA-N
XLogP3.40
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.51
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-tert-butyl-2-(diethylaminomethyl)-N-ethylcyclohexan-1-amine
CID 63483579
4-tert-butyl-2-[[ethyl(propyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 63483435
4-tert-butyl-2-[[cyclopropyl(methyl)amino]methyl]-N-ethylcyclohexan-1-amine
CID 62614673
2-[[ethyl(2-methoxyethyl)amino]methyl]-N,4-dipropylcyclohexan-1-amine
CID 63495212
2-[[2-ethoxyethyl(ethyl)amino]methyl]-N-ethyl-4-propan-2-ylcyclohexan-1-amine
CID 63690532
N-ethyl-2-[[2-methoxyethyl(3-methoxypropyl)amino]methyl]cyclohexan-1-amine
CID 62614429
4-tert-butyl-N-ethyl-2-[[methyl(1-methylsulfanylpropan-2-yl)amino]methyl]cyclohexan-1-amine
CID 115987570
2-[[ethyl(2-methoxyethyl)amino]methyl]-N-methyl-4-propan-2-ylcyclohexan-1-amine
CID 55106257
2-[[ethyl(2-methoxyethyl)amino]methyl]-N-methylcyclohexan-1-amine
CID 62616551
2-[2-[bis(2-methoxyethyl)amino]ethyl]-N-ethylcyclopentan-1-amine
CID 79565195
2-[[2-ethoxyethyl(ethyl)amino]methyl]-N-ethylcycloheptan-1-amine
CID 63692668
N-ethyl-2-[[ethyl(propyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63483436

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine (CID 62610178) is 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine is CCNC1CCC(C(C)(C)C)CC1CN(CC)CCOC.
What is the InChIKey of 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is ZUVDMSMTTQBAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2O/c1-7-19-17-10-9-16(18(3,4)5)13-15(17)14-20(8-2)11-12-21-6/h15-17,19H,7-14H2,1-6H3.
What are the key properties of 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine?
4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 298.51 g/mol, XLogP of 3.40, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-ethyl-2-[[ethyl(2-methoxyethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 62610178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).