N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine

C15H24N2 — CID 792378

IUPACN,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine
SMILESCc1ccc(CN(C)C2CCN(C)CC2)cc1
InChIInChI=1S/C15H24N2/c1-13-4-6-14(7-5-13)12-17(3)15-8-10-16(2)11-9-15/h4-7,15H,8-12H2,1-3H3
InChIKeyBHHSJAFDBBXQJW-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.52
Rot. Bonds3

About N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine

N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine (PubChem CID 792378) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine
PubChem CID792378
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine
SMILESCc1ccc(CN(C)C2CCN(C)CC2)cc1
InChIInChI=1S/C15H24N2/c1-13-4-6-14(7-5-13)12-17(3)15-8-10-16(2)11-9-15/h4-7,15H,8-12H2,1-3H3
InChIKeyBHHSJAFDBBXQJW-UHFFFAOYSA-N
XLogP2.52
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine?
The IUPAC name of N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine (CID 792378) is N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine.
What is the SMILES notation for N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine?
The canonical SMILES for N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine is Cc1ccc(CN(C)C2CCN(C)CC2)cc1.
What is the InChIKey of N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine?
The InChIKey is BHHSJAFDBBXQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13-4-6-14(7-5-13)12-17(3)15-8-10-16(2)11-9-15/h4-7,15H,8-12H2,1-3H3.
What are the key properties of N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine?
N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine has a molecular weight of 232.37 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[(4-methylphenyl)methyl]piperidin-4-amine is sourced from PubChem (CID 792378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).