N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine

C16H26N2 — CID 83006518

IUPACN-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine
SMILESCc1ccc(CNN2C(C)CCCC2C)c(C)c1
InChIInChI=1S/C16H26N2/c1-12-8-9-16(13(2)10-12)11-17-18-14(3)6-5-7-15(18)4/h8-10,14-15,17H,5-7,11H2,1-4H3
InChIKeyLKSNOMIETLEPPF-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.57
Rot. Bonds3

About N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine

N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine (PubChem CID 83006518) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine
PubChem CID83006518
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC NameN-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine
SMILESCc1ccc(CNN2C(C)CCCC2C)c(C)c1
InChIInChI=1S/C16H26N2/c1-12-8-9-16(13(2)10-12)11-17-18-14(3)6-5-7-15(18)4/h8-10,14-15,17H,5-7,11H2,1-4H3
InChIKeyLKSNOMIETLEPPF-UHFFFAOYSA-N
XLogP3.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-bromo-4-methylphenyl)methyl]-2,6-dimethylpiperidin-1-amine
CID 83010449
N-[[4-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]phenyl]methyl]-2,6-dimethylpiperidin-1-amine
CID 24896833
N-[(2,4-dimethylphenyl)methyl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 65471992
N-[(2,5-dimethoxyphenyl)methyl]-2,6-dimethylpiperidin-1-amine
CID 83010248
2-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-4-methoxyphenol
CID 83007608
3-[[(2,4-dimethylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699981
N-[(2,4-dimethylphenyl)methyl]-2,2-dimethylcyclopentan-1-amine
CID 79861534
N-(1-benzofuran-3-ylmethyl)-2,6-dimethylpiperidin-1-amine
CID 83009936
N-[(2,4-dimethylphenyl)methyl]-3-ethyl-2-methylcyclopentan-1-amine
CID 64923688
N-(1,3-benzodioxol-4-ylmethyl)-2,6-dimethylpiperidin-1-amine
CID 83007219
1-cyclohexyl-N-[(2,4-dimethylphenyl)methyl]ethanamine
CID 63479047
2,6-dimethyl-N-(quinolin-8-ylmethyl)piperidin-1-amine
CID 83007197

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine (CID 83006518) is N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine is Cc1ccc(CNN2C(C)CCCC2C)c(C)c1.
What is the InChIKey of N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine?
The InChIKey is LKSNOMIETLEPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-12-8-9-16(13(2)10-12)11-17-18-14(3)6-5-7-15(18)4/h8-10,14-15,17H,5-7,11H2,1-4H3.
What are the key properties of N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine?
N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine has a molecular weight of 246.40 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethylphenyl)methyl]-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83006518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).