4-[(2-methylanilino)methyl]pyridin-2-amine

C13H15N3 — CID 105466971

IUPAC4-[(2-methylanilino)methyl]pyridin-2-amine
SMILESCc1ccccc1NCc1ccnc(N)c1
InChIInChI=1S/C13H15N3/c1-10-4-2-3-5-12(10)16-9-11-6-7-15-13(14)8-11/h2-8,16H,9H2,1H3,(H2,14,15)
InChIKeyOPDKSIYXRGDJHR-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.58
Rot. Bonds3

About 4-[(2-methylanilino)methyl]pyridin-2-amine

4-[(2-methylanilino)methyl]pyridin-2-amine (PubChem CID 105466971) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-[(2-methylanilino)methyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[(2-methylanilino)methyl]pyridin-2-amine
PubChem CID105466971
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name4-[(2-methylanilino)methyl]pyridin-2-amine
SMILESCc1ccccc1NCc1ccnc(N)c1
InChIInChI=1S/C13H15N3/c1-10-4-2-3-5-12(10)16-9-11-6-7-15-13(14)8-11/h2-8,16H,9H2,1H3,(H2,14,15)
InChIKeyOPDKSIYXRGDJHR-UHFFFAOYSA-N
XLogP2.58
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-4-pyridinyl)methylamino]phenol
CID 105468629
8-[(2-amino-4-pyridinyl)methylamino]-N-(2-methylphenyl)-6-oxo-5-azaspiro[3.5]non-7-ene-7-carbothioamide
CID 154674292
N-[(4-bromo-3-methylphenyl)methyl]-2-methylaniline
CID 66472582
4-[(methoxyamino)methyl]pyridin-2-amine
CID 131155794
2-[(2-amino-4-pyridinyl)methylamino]-N-isoquinolin-3-ylbenzamide
CID 58763653
3-[(2-methylanilino)methyl]pyridin-4-amine
CID 105466959
N-[(3-butoxyphenyl)methyl]-2-methylaniline
CID 39369088
N-[(3-ethoxy-4-methoxyphenyl)methyl]-2-methylaniline
CID 900370
2-[(2-amino-4-pyridinyl)methylamino]-N-(1-methylindazol-6-yl)benzamide
CID 68820475
ethane;4-ethylpyridin-2-amine
CID 144736585
4-[2-(3-methylphenyl)ethyl]pyridin-2-amine
CID 56992770
2-N-[(3-methyl-2-pyridinyl)methyl]benzene-1,2-diamine
CID 63305875

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylanilino)methyl]pyridin-2-amine?
The IUPAC name of 4-[(2-methylanilino)methyl]pyridin-2-amine (CID 105466971) is 4-[(2-methylanilino)methyl]pyridin-2-amine.
What is the SMILES notation for 4-[(2-methylanilino)methyl]pyridin-2-amine?
The canonical SMILES for 4-[(2-methylanilino)methyl]pyridin-2-amine is Cc1ccccc1NCc1ccnc(N)c1.
What is the InChIKey of 4-[(2-methylanilino)methyl]pyridin-2-amine?
The InChIKey is OPDKSIYXRGDJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10-4-2-3-5-12(10)16-9-11-6-7-15-13(14)8-11/h2-8,16H,9H2,1H3,(H2,14,15).
What are the key properties of 4-[(2-methylanilino)methyl]pyridin-2-amine?
4-[(2-methylanilino)methyl]pyridin-2-amine has a molecular weight of 213.28 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylanilino)methyl]pyridin-2-amine is sourced from PubChem (CID 105466971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).