N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine

C16H20N2 — CID 70611813

IUPACN,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
SMILESCc1ccc(C(C)N(C)c2ccc(C)cn2)cc1
InChIInChI=1S/C16H20N2/c1-12-5-8-15(9-6-12)14(3)18(4)16-10-7-13(2)11-17-16/h5-11,14H,1-4H3
InChIKeyPHXZRRHDQZUAPF-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.90
Rot. Bonds3

About N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine

N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine (PubChem CID 70611813) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
PubChem CID70611813
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine
SMILESCc1ccc(C(C)N(C)c2ccc(C)cn2)cc1
InChIInChI=1S/C16H20N2/c1-12-5-8-15(9-6-12)14(3)18(4)16-10-7-13(2)11-17-16/h5-11,14H,1-4H3
InChIKeyPHXZRRHDQZUAPF-UHFFFAOYSA-N
XLogP3.90
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
The IUPAC name of N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine (CID 70611813) is N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine.
What is the SMILES notation for N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
The canonical SMILES for N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine is Cc1ccc(C(C)N(C)c2ccc(C)cn2)cc1.
What is the InChIKey of N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
The InChIKey is PHXZRRHDQZUAPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-12-5-8-15(9-6-12)14(3)18(4)16-10-7-13(2)11-17-16/h5-11,14H,1-4H3.
What are the key properties of N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine?
N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine has a molecular weight of 240.35 g/mol, XLogP of 3.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[1-(4-methylphenyl)ethyl]pyridin-2-amine is sourced from PubChem (CID 70611813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).