N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine

C16H20N2 — CID 105090642

IUPACN-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine
SMILESCNC(CCc1cccnc1)c1cccc(C)c1
InChIInChI=1S/C16H20N2/c1-13-5-3-7-15(11-13)16(17-2)9-8-14-6-4-10-18-12-14/h3-7,10-12,16-17H,8-9H2,1-2H3
InChIKeyONLRULZTKNSCGD-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.28
Rot. Bonds5

About N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine

N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine (PubChem CID 105090642) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine
PubChem CID105090642
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC NameN-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine
SMILESCNC(CCc1cccnc1)c1cccc(C)c1
InChIInChI=1S/C16H20N2/c1-13-5-3-7-15(11-13)16(17-2)9-8-14-6-4-10-18-12-14/h3-7,10-12,16-17H,8-9H2,1-2H3
InChIKeyONLRULZTKNSCGD-UHFFFAOYSA-N
XLogP3.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(3-methylphenyl)-3-phenylpropan-1-amine
CID 60818529
1-(3,4-dichlorophenyl)-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 105076807
1-(4-tert-butylphenyl)-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 105140459
1-(3-fluorophenyl)-N-methyl-3-(3-methylphenyl)propan-1-amine
CID 105092929
1-(2-fluoro-4,6-dimethylphenyl)-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 106883832
3-(4-methoxyphenyl)-N-methyl-1-(3-methylphenyl)propan-1-amine
CID 65444758
N-methyl-1-(5-methylthiophen-2-yl)-3-pyridin-3-ylpropan-1-amine
CID 105162051
N-ethyl-1-(3-ethylphenyl)-3-pyridin-3-ylpropan-1-amine
CID 105171233
N-methyl-1-(3-methylphenyl)-2-pyridin-4-ylethanamine
CID 62550882
N-methyl-1-(5-methyl-3-pyridinyl)-2-pyridin-3-ylethanamine
CID 113297193
1-(2-chlorophenyl)-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 105099694
1-(4-methylphenyl)-N-propyl-3-pyridin-3-ylpropan-1-amine
CID 105092564

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine?
The IUPAC name of N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine (CID 105090642) is N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine.
What is the SMILES notation for N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine?
The canonical SMILES for N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine is CNC(CCc1cccnc1)c1cccc(C)c1.
What is the InChIKey of N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine?
The InChIKey is ONLRULZTKNSCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-13-5-3-7-15(11-13)16(17-2)9-8-14-6-4-10-18-12-14/h3-7,10-12,16-17H,8-9H2,1-2H3.
What are the key properties of N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine?
N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine has a molecular weight of 240.35 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylphenyl)-3-pyridin-3-ylpropan-1-amine is sourced from PubChem (CID 105090642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).