3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine

C17H35N3 — CID 64735863

IUPAC3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
SMILESCC1CC(C)C(CN(C)CC2CCN(C)CC2)C(N)C1
InChIInChI=1S/C17H35N3/c1-13-9-14(2)16(17(18)10-13)12-20(4)11-15-5-7-19(3)8-6-15/h13-17H,5-12,18H2,1-4H3
InChIKeyRVPWQFPDWAGYED-UHFFFAOYSA-N
MW281.49 g/mol
LogP2.27
Rot. Bonds4

About 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine

3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine (PubChem CID 64735863) has the molecular formula C17H35N3 and a molecular weight of 281.49 g/mol. Its IUPAC name is 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
PubChem CID64735863
Molecular FormulaC17H35N3
Molecular Weight281.49 g/mol
Exact Mass281.28
IUPAC Name3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
SMILESCC1CC(C)C(CN(C)CC2CCN(C)CC2)C(N)C1
InChIInChI=1S/C17H35N3/c1-13-9-14(2)16(17(18)10-13)12-20(4)11-15-5-7-19(3)8-6-15/h13-17H,5-12,18H2,1-4H3
InChIKeyRVPWQFPDWAGYED-UHFFFAOYSA-N
XLogP2.27
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.49
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine with MolForge

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Related Compounds

2-[[cyclopropylmethyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64736034
N-methyl-N-[(3-methylcyclobutyl)methyl]-1-(1-methylpiperidin-4-yl)methanamine
CID 176641060
N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 169319670
N-methyl-1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 176641061
3-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 63234589
2-[[3-methoxypropyl(methyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64736449
3,5-dimethyl-2-[[methyl-[(4-methylphenyl)methyl]amino]methyl]cyclohexan-1-amine
CID 64737587
3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 64736070
[1-[(2-amino-4,6-dimethylcyclohexyl)methyl]piperidin-4-yl]methanol
CID 64735025
3,5-dimethyl-2-[[methyl(pyridin-4-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 64735628
2-[[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64734682
1-[(2-amino-4,6-dimethylcyclohexyl)methyl]-N,N-dimethylpyrrolidin-3-amine
CID 64734685

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine (CID 64735863) is 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine is CC1CC(C)C(CN(C)CC2CCN(C)CC2)C(N)C1.
What is the InChIKey of 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine?
The InChIKey is RVPWQFPDWAGYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3/c1-13-9-14(2)16(17(18)10-13)12-20(4)11-15-5-7-19(3)8-6-15/h13-17H,5-12,18H2,1-4H3.
What are the key properties of 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine?
3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine has a molecular weight of 281.49 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-[[methyl-[(1-methylpiperidin-4-yl)methyl]amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 64735863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).