2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine

C15H30N2 — CID 64762697

IUPAC2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine
SMILESCC1CCC(C)C(NCC2CCN(C)CC2)C1
InChIInChI=1S/C15H30N2/c1-12-4-5-13(2)15(10-12)16-11-14-6-8-17(3)9-7-14/h12-16H,4-11H2,1-3H3
InChIKeyIKPVJDAYDJFFAP-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.74
Rot. Bonds3

About 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine

2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine (PubChem CID 64762697) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine
PubChem CID64762697
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine
SMILESCC1CCC(C)C(NCC2CCN(C)CC2)C1
InChIInChI=1S/C15H30N2/c1-12-4-5-13(2)15(10-12)16-11-14-6-8-17(3)9-7-14/h12-16H,4-11H2,1-3H3
InChIKeyIKPVJDAYDJFFAP-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexan-1-amine
CID 64762279
trans-(1R,2R)-2-methyl-N-[(4-methylcyclohexyl)methyl]cyclopropan-1-amine
CID 130624100
1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 63243077
N-(cyclopropylmethyl)-1,4-dimethylpyrrolidin-3-amine
CID 131041729
1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 62657369
N-(2,5-dimethylcyclohexyl)-N',N'-dimethylethane-1,2-diamine
CID 64776142
1-methyl-N-[(4-methylcyclohexyl)methyl]azepan-4-amine
CID 65075081
2,4,4-trimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]cyclopentan-1-amine
CID 106662241
2,5-dimethyl-N-(oxan-2-ylmethyl)cyclohexan-1-amine
CID 64761101
4-[[(2,4-dimethylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 106127277
N-[[4-(aminomethyl)cyclohexyl]methyl]-2-methylcyclopropan-1-amine
CID 79532868
1,3-dimethyl-N-(oxetan-3-ylmethyl)piperidin-4-amine
CID 176675930

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine (CID 64762697) is 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine is CC1CCC(C)C(NCC2CCN(C)CC2)C1.
What is the InChIKey of 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine?
The InChIKey is IKPVJDAYDJFFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12-4-5-13(2)15(10-12)16-11-14-6-8-17(3)9-7-14/h12-16H,4-11H2,1-3H3.
What are the key properties of 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine?
2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 64762697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).