2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine

C18H37NO — CID 63474982

IUPAC2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine
SMILESCC(C)COC1(CNC(C)(C)C)CCC(C(C)C)CC1
InChIInChI=1S/C18H37NO/c1-14(2)12-20-18(13-19-17(5,6)7)10-8-16(9-11-18)15(3)4/h14-16,19H,8-13H2,1-7H3
InChIKeyYCDQCEMVDAPCPH-UHFFFAOYSA-N
MW283.50 g/mol
LogP4.63
Rot. Bonds6

About 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine

2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine (PubChem CID 63474982) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine
PubChem CID63474982
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine
SMILESCC(C)COC1(CNC(C)(C)C)CCC(C(C)C)CC1
InChIInChI=1S/C18H37NO/c1-14(2)12-20-18(13-19-17(5,6)7)10-8-16(9-11-18)15(3)4/h14-16,19H,8-13H2,1-7H3
InChIKeyYCDQCEMVDAPCPH-UHFFFAOYSA-N
XLogP4.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[1-(2,2-difluoroethoxy)-4-propan-2-ylcyclohexyl]methyl]-2-methylpropan-2-amine
CID 82007210
1-(iodomethyl)-1-(2-methylpropoxy)-4-propan-2-ylcyclohexane
CID 114772775
N-[[4-tert-butyl-1-(2,2-difluoroethoxy)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 82005818
N-[[1-(2,2-difluoroethoxy)-4-propan-2-ylcyclohexyl]methyl]ethanamine
CID 82007334
N-[[1-(3-methylbutoxy)-4-propan-2-ylcyclohexyl]methyl]propan-1-amine
CID 63475515
N-[(1-ethoxy-4-propan-2-ylcyclohexyl)methyl]ethanamine
CID 62108168
N-[(4-tert-butyl-1-propoxycyclohexyl)methyl]-2-methylpropan-2-amine
CID 63473883
N-[[4-tert-butyl-1-(cyclopropylmethoxy)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 63474782
N-[(1-methoxy-4-methylcyclohexyl)methyl]-2-methylpropan-2-amine
CID 62108177
N-[[4-propan-2-yl-1-(2,2,2-trifluoroethoxy)cyclohexyl]methyl]cyclopropanamine
CID 62109071
N-[[1-(2-cyclopropylethoxy)-4-propan-2-ylcyclohexyl]methyl]ethanamine
CID 106204886
N-[[1-(cyclopropylmethoxy)cycloheptyl]methyl]-2-methylpropan-2-amine
CID 62108400

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine (CID 63474982) is 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine is CC(C)COC1(CNC(C)(C)C)CCC(C(C)C)CC1.
What is the InChIKey of 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine?
The InChIKey is YCDQCEMVDAPCPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-14(2)12-20-18(13-19-17(5,6)7)10-8-16(9-11-18)15(3)4/h14-16,19H,8-13H2,1-7H3.
What are the key properties of 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine?
2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine has a molecular weight of 283.50 g/mol, XLogP of 4.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(2-methylpropoxy)-4-propan-2-ylcyclohexyl]methyl]propan-2-amine is sourced from PubChem (CID 63474982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).