N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine

C16H32N2 — CID 176641061

IUPACN-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
SMILESCC1CCC(CN(C)CC2CCN(C)CC2)CC1
InChIInChI=1S/C16H32N2/c1-14-4-6-15(7-5-14)12-18(3)13-16-8-10-17(2)11-9-16/h14-16H,4-13H2,1-3H3
InChIKeySFAGYNRBOPQPCL-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.09
Rot. Bonds4

About N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine

N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine (PubChem CID 176641061) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
PubChem CID176641061
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC NameN-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
SMILESCC1CCC(CN(C)CC2CCN(C)CC2)CC1
InChIInChI=1S/C16H32N2/c1-14-4-6-15(7-5-14)12-18(3)13-16-8-10-17(2)11-9-16/h14-16H,4-13H2,1-3H3
InChIKeySFAGYNRBOPQPCL-UHFFFAOYSA-N
XLogP3.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 169319670
N-methyl-N-[(3-methylcyclobutyl)methyl]-1-(1-methylpiperidin-4-yl)methanamine
CID 176641060
[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methanethiol
CID 115228180
1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 63243077
N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidin-4-amine
CID 59369351
3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 64735863
bis(N,N-dimethyl-1-(4-methylcyclohexyl)methanamine);1,4-dimethylpiperidine;1,3-dimethylpyrrolidine;bis(4-ethyl-N,N-dimethylcyclohexan-1-amine);4-ethyl-1-methylpiperidine;bis(N,N,4-trimethylcyclohexan-1-amine)
CID 161481223
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]cyclopropanamine
CID 138723132
N-methyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 63234425
1,5,8,11-tetramethyl-1,5-diazacyclotridecane
CID 10610105
N-(cyclopropylmethyl)-1-methyl-N-propylpiperidin-4-amine
CID 30983644
3-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 63234589

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The IUPAC name of N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine (CID 176641061) is N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine.
What is the SMILES notation for N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The canonical SMILES for N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine is CC1CCC(CN(C)CC2CCN(C)CC2)CC1.
What is the InChIKey of N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The InChIKey is SFAGYNRBOPQPCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-14-4-6-15(7-5-14)12-18(3)13-16-8-10-17(2)11-9-16/h14-16H,4-13H2,1-3H3.
What are the key properties of N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine has a molecular weight of 252.45 g/mol, XLogP of 3.09, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine is sourced from PubChem (CID 176641061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).