N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine

C18H30N2 — CID 62611056

IUPACN,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine
SMILESCNC1CCC(C)CC1CN(C)Cc1ccccc1C
InChIInChI=1S/C18H30N2/c1-14-9-10-18(19-3)17(11-14)13-20(4)12-16-8-6-5-7-15(16)2/h5-8,14,17-19H,9-13H2,1-4H3
InChIKeyJEOWJTJGDPLQPW-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.45
Rot. Bonds5

About N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine

N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine (PubChem CID 62611056) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine
PubChem CID62611056
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine
SMILESCNC1CCC(C)CC1CN(C)Cc1ccccc1C
InChIInChI=1S/C18H30N2/c1-14-9-10-18(19-3)17(11-14)13-20(4)12-16-8-6-5-7-15(16)2/h5-8,14,17-19H,9-13H2,1-4H3
InChIKeyJEOWJTJGDPLQPW-UHFFFAOYSA-N
XLogP3.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62616448
N-ethyl-2-methyl-N-[[5-methyl-2-(methylamino)cyclohexyl]methyl]aniline
CID 63483418
N,4-dimethyl-2-[[methyl(thiophen-3-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62616435
4-methyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-one
CID 62613387
2-[[benzyl(methyl)amino]methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 63483230
N,4-dimethyl-2-[[methyl(pentyl)amino]methyl]cyclohexan-1-amine
CID 62615388
N,2-dimethyl-3-[(2-methylphenyl)methyl]cyclopentan-1-amine
CID 64907888
1-N,3-N-dimethyl-3-N-[(2-methylphenyl)methyl]cyclopentane-1,3-diamine
CID 79643894
4-tert-butyl-N-methyl-2-[(2-methylphenyl)methyl]cyclohexan-1-amine
CID 63401092
N,4-dimethyl-2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]cyclohexan-1-amine
CID 79486822
1-(azepan-2-yl)-N-methyl-N-[(2-methylphenyl)methyl]methanamine
CID 64569172
N,4-dimethyl-2-(2-phenylsulfanylethyl)cyclohexan-1-amine
CID 79227744

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine?
The IUPAC name of N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine (CID 62611056) is N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine?
The canonical SMILES for N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine is CNC1CCC(C)CC1CN(C)Cc1ccccc1C.
What is the InChIKey of N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine?
The InChIKey is JEOWJTJGDPLQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-14-9-10-18(19-3)17(11-14)13-20(4)12-16-8-6-5-7-15(16)2/h5-8,14,17-19H,9-13H2,1-4H3.
What are the key properties of N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine?
N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine has a molecular weight of 274.45 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 62611056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).