3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline

C14H16N2 — CID 115671114

IUPAC3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline
SMILESCc1cccc(NCc2cccnc2C)c1
InChIInChI=1S/C14H16N2/c1-11-5-3-7-14(9-11)16-10-13-6-4-8-15-12(13)2/h3-9,16H,10H2,1-2H3
InChIKeyMNWFCWYOJUEKCJ-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.31
Rot. Bonds3

About 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline

3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline (PubChem CID 115671114) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline.

Molecular Properties

Compound Name3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline
PubChem CID115671114
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline
SMILESCc1cccc(NCc2cccnc2C)c1
InChIInChI=1S/C14H16N2/c1-11-5-3-7-14(9-11)16-10-13-6-4-8-15-12(13)2/h3-9,16H,10H2,1-2H3
InChIKeyMNWFCWYOJUEKCJ-UHFFFAOYSA-N
XLogP3.31
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methyl-3-pyridinyl)methylamino]phenol
CID 99790074
N-[(2-methyl-3-pyridinyl)methyl]pyridin-3-amine
CID 115692632
N-[(2-ethylphenyl)methyl]-3-methylaniline
CID 21444100
N-[(2-methyl-3-pyridinyl)methyl]pyridin-2-amine
CID 115692595
2-[2-[(3-methylanilino)methyl]phenyl]acetic acid
CID 115461361
N-[[3-(aminomethyl)-4-pyridinyl]methyl]-3-methylaniline
CID 105484928
N-[(2,3-dimethoxyphenyl)methyl]-3-methylaniline
CID 784077
2-[(3-methylanilino)methyl]benzene-1,4-diol
CID 82681028
2-[(3-methylanilino)methyl]pyrimidin-4-amine
CID 105467878
5-methyl-3-N-(quinolin-8-ylmethyl)benzene-1,3-diamine
CID 115980853
5-(hydroxymethyl)-2-methyl-4-[(3-methylanilino)methyl]pyridin-3-ol
CID 20914681
N-[(2,4-dimethylphenyl)methyl]-2-methylpyridin-3-amine
CID 79041859

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline?
The IUPAC name of 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline (CID 115671114) is 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline.
What is the SMILES notation for 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline?
The canonical SMILES for 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline is Cc1cccc(NCc2cccnc2C)c1.
What is the InChIKey of 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline?
The InChIKey is MNWFCWYOJUEKCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-11-5-3-7-14(9-11)16-10-13-6-4-8-15-12(13)2/h3-9,16H,10H2,1-2H3.
What are the key properties of 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline?
3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline has a molecular weight of 212.30 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(2-methyl-3-pyridinyl)methyl]aniline is sourced from PubChem (CID 115671114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).