N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine

C15H24N2 — CID 63642105

IUPACN-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine
SMILESCc1ccc(CN(C)C2CCCNC2)c(C)c1
InChIInChI=1S/C15H24N2/c1-12-6-7-14(13(2)9-12)11-17(3)15-5-4-8-16-10-15/h6-7,9,15-16H,4-5,8,10-11H2,1-3H3
InChIKeyYJRSLPKIDJEIOA-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.49
Rot. Bonds3

About N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine

N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine (PubChem CID 63642105) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine
PubChem CID63642105
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine
SMILESCc1ccc(CN(C)C2CCCNC2)c(C)c1
InChIInChI=1S/C15H24N2/c1-12-6-7-14(13(2)9-12)11-17(3)15-5-4-8-16-10-15/h6-7,9,15-16H,4-5,8,10-11H2,1-3H3
InChIKeyYJRSLPKIDJEIOA-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-chloro-4-methylphenyl)methyl]-N-methylpiperidin-3-amine
CID 106865573
N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-4-amine
CID 83713467
N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-piperidin-3-ylethanamine
CID 115211401
N-[(2-bromo-4-methylphenyl)methyl]-N-methylazepan-4-amine
CID 107172051
N-[(4-fluoro-3-methylphenyl)methyl]-N-methylpiperidin-3-amine
CID 63643681
N-[(2,4-dimethylphenyl)methyl]-N,2,2-trimethylpiperidin-4-amine
CID 115145537
N-[(3-chloro-4-methylphenyl)methyl]-N-methylpiperidin-3-amine
CID 106817825
N-methyl-N-[(6-methyl-1,3-benzodioxol-5-yl)methyl]pyrrolidin-3-amine
CID 115118961
N-[(5-fluoro-2-methoxyphenyl)methyl]-N-methylpiperidin-3-amine
CID 63643030
N-[(2-bromo-5-methoxyphenyl)methyl]-N-methylpiperidin-3-amine
CID 65327435
N,2,4-trimethyl-N-piperidin-3-ylbenzamide
CID 60807214
3-(2,4-dimethylphenyl)-1-piperidin-3-ylpropan-1-one
CID 82294914

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine?
The IUPAC name of N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine (CID 63642105) is N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine.
What is the SMILES notation for N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine?
The canonical SMILES for N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine is Cc1ccc(CN(C)C2CCCNC2)c(C)c1.
What is the InChIKey of N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine?
The InChIKey is YJRSLPKIDJEIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-6-7-14(13(2)9-12)11-17(3)15-5-4-8-16-10-15/h6-7,9,15-16H,4-5,8,10-11H2,1-3H3.
What are the key properties of N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine?
N-[(2,4-dimethylphenyl)methyl]-N-methylpiperidin-3-amine has a molecular weight of 232.37 g/mol, XLogP of 2.49, 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]-N-methylpiperidin-3-amine is sourced from PubChem (CID 63642105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).