1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine

C18H37NO2 — CID 103036146

IUPAC1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine
SMILESCCCNC(CCC(C)(C)OC)C(OC)C1CCCCC1
InChIInChI=1S/C18H37NO2/c1-6-14-19-16(12-13-18(2,3)21-5)17(20-4)15-10-8-7-9-11-15/h15-17,19H,6-14H2,1-5H3
InChIKeyAUDKQGGHOLCSOO-UHFFFAOYSA-N
MW299.50 g/mol
LogP4.16
Rot. Bonds10

About 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine

1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine (PubChem CID 103036146) has the molecular formula C18H37NO2 and a molecular weight of 299.50 g/mol. Its IUPAC name is 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine
PubChem CID103036146
Molecular FormulaC18H37NO2
Molecular Weight299.50 g/mol
Exact Mass299.28
IUPAC Name1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine
SMILESCCCNC(CCC(C)(C)OC)C(OC)C1CCCCC1
InChIInChI=1S/C18H37NO2/c1-6-14-19-16(12-13-18(2,3)21-5)17(20-4)15-10-8-7-9-11-15/h15-17,19H,6-14H2,1-5H3
InChIKeyAUDKQGGHOLCSOO-UHFFFAOYSA-N
XLogP4.16
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.50
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethoxy-N,6-dimethylheptan-3-amine
CID 103031620
2,6-dimethoxy-6-methyl-N-propylheptan-3-amine
CID 103031782
4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine
CID 103035951
N-ethyl-4-methoxy-4-methyl-1-(2-methyloxan-2-yl)pentan-1-amine
CID 103035952
4-methoxy-4-methyl-1-(2-methyloxan-2-yl)-N-propylpentan-1-amine
CID 103035953
N-ethyl-4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine
CID 103036041
4-methoxy-1-(1-methoxycyclopentyl)-4-methyl-N-propylpentan-1-amine
CID 103036042
4-methoxy-1-(1-methoxycyclobutyl)-N,4-dimethylpentan-1-amine
CID 103036052
N-ethyl-4-methoxy-1-(1-methoxycyclobutyl)-4-methylpentan-1-amine
CID 103036053
3,7-dimethoxy-N,7-dimethyloctan-4-amine
CID 103036055
N-ethyl-3,7-dimethoxy-7-methyloctan-4-amine
CID 103036056
3-ethoxy-7-methoxy-N,7-dimethyloctan-4-amine
CID 103036058

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine?
The IUPAC name of 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine (CID 103036146) is 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine.
What is the SMILES notation for 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine?
The canonical SMILES for 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine is CCCNC(CCC(C)(C)OC)C(OC)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine?
The InChIKey is AUDKQGGHOLCSOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO2/c1-6-14-19-16(12-13-18(2,3)21-5)17(20-4)15-10-8-7-9-11-15/h15-17,19H,6-14H2,1-5H3.
What are the key properties of 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine?
1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine has a molecular weight of 299.50 g/mol, XLogP of 4.16, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1,5-dimethoxy-5-methyl-N-propylhexan-2-amine is sourced from PubChem (CID 103036146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).