N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine

C15H31N3 — CID 115213642

IUPACN,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine
SMILESCNC1CCC(CN(C)C2CCCN(C)C2)CC1
InChIInChI=1S/C15H31N3/c1-16-14-8-6-13(7-9-14)11-18(3)15-5-4-10-17(2)12-15/h13-16H,4-12H2,1-3H3
InChIKeyVHZMDQWUESVGPQ-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds4

About N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine

N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine (PubChem CID 115213642) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine
PubChem CID115213642
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine
SMILESCNC1CCC(CN(C)C2CCCN(C)C2)CC1
InChIInChI=1S/C15H31N3/c1-16-14-8-6-13(7-9-14)11-18(3)15-5-4-10-17(2)12-15/h13-16H,4-12H2,1-3H3
InChIKeyVHZMDQWUESVGPQ-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(aminomethyl)cyclohexyl]methyl]-N,1-dimethylpiperidin-3-amine
CID 79532954
N,1-dimethyl-N-(piperidin-4-ylmethyl)piperidin-3-amine
CID 62546416
1-cyclopentyl-N,N'-dimethyl-N'-(1-methylpiperidin-3-yl)ethane-1,2-diamine
CID 104745946
N-methyl-4-[(1-methylpiperidin-3-yl)methyl]cyclohexan-1-amine
CID 116926394
N'-methyl-N-(4-methylcyclohexyl)-N'-(1-methylpiperidin-3-yl)ethane-1,2-diamine
CID 62561053
2-[methyl-[(3R)-1-methylpiperidin-3-yl]amino]ethanol
CID 66565626
N-(methoxymethyl)-N,1-dimethylpiperidin-3-amine
CID 115258466
2-[methyl-(1-methylpiperidin-3-yl)amino]acetonitrile
CID 62548009
N-[[4-(ethylamino)oxolan-3-yl]methyl]-N,1-dimethylpiperidin-3-amine
CID 66258960
N,1-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]piperidin-4-amine
CID 59369351
N'-methyl-N'-(1-methylpiperidin-3-yl)propane-1,3-diamine
CID 62545866
4-[[methyl-(1-methylpyrrolidin-3-yl)amino]methyl]cyclohexan-1-one
CID 115240121

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine?
The IUPAC name of N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine (CID 115213642) is N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine.
What is the SMILES notation for N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine?
The canonical SMILES for N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine is CNC1CCC(CN(C)C2CCCN(C)C2)CC1.
What is the InChIKey of N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine?
The InChIKey is VHZMDQWUESVGPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-16-14-8-6-13(7-9-14)11-18(3)15-5-4-10-17(2)12-15/h13-16H,4-12H2,1-3H3.
What are the key properties of N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine?
N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[[4-(methylamino)cyclohexyl]methyl]piperidin-3-amine is sourced from PubChem (CID 115213642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).