N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine

C18H36N2O — CID 106606246

IUPACN-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
SMILESCOCCN(CC1CCCN1)C1CC(C)CCC1C(C)C
InChIInChI=1S/C18H36N2O/c1-14(2)17-8-7-15(3)12-18(17)20(10-11-21-4)13-16-6-5-9-19-16/h14-19H,5-13H2,1-4H3
InChIKeyJASKEWZQKBXMDD-UHFFFAOYSA-N
MW296.50 g/mol
LogP3.15
Rot. Bonds7

About N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine

N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine (PubChem CID 106606246) has the molecular formula C18H36N2O and a molecular weight of 296.50 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
PubChem CID106606246
Molecular FormulaC18H36N2O
Molecular Weight296.50 g/mol
Exact Mass296.28
IUPAC NameN-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
SMILESCOCCN(CC1CCCN1)C1CC(C)CCC1C(C)C
InChIInChI=1S/C18H36N2O/c1-14(2)17-8-7-15(3)12-18(17)20(10-11-21-4)13-16-6-5-9-19-16/h14-19H,5-13H2,1-4H3
InChIKeyJASKEWZQKBXMDD-UHFFFAOYSA-N
XLogP3.15
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
CID 106621811
4-ethyl-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106605809
N-(2-methylpropyl)-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106605387
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 106606366
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)but-3-en-2-amine
CID 106617658
N-[2-(2-methoxyethoxy)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106614604
N-(2-methoxyethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)pentan-1-amine
CID 106606339
3-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 107449581
2-[2-methoxyethyl(pyrrolidin-2-ylmethyl)amino]propanoic acid
CID 106617509
1-cyclopropyl-N-(2-methoxyethyl)-N-[(4-methylpiperidin-2-yl)methyl]ethanamine
CID 114421390
4-methoxy-N-methyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 106602392
3-methoxy-N-(2-methoxyethyl)-N-[[(2R)-pyrrolidin-2-yl]methyl]propan-1-amine
CID 102819399

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine (CID 106606246) is N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine is COCCN(CC1CCCN1)C1CC(C)CCC1C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is JASKEWZQKBXMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O/c1-14(2)17-8-7-15(3)12-18(17)20(10-11-21-4)13-16-6-5-9-19-16/h14-19H,5-13H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 296.50 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5-methyl-2-propan-2-yl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 106606246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).