2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine

C12H15N3 — CID 79041862

IUPAC2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
SMILESCc1ncccc1NCc1ccn(C)c1
InChIInChI=1S/C12H15N3/c1-10-12(4-3-6-13-10)14-8-11-5-7-15(2)9-11/h3-7,9,14H,8H2,1-2H3
InChIKeyALIGDHAOOIOOBA-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.34
Rot. Bonds3

About 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine

2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine (PubChem CID 79041862) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
PubChem CID79041862
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
SMILESCc1ncccc1NCc1ccn(C)c1
InChIInChI=1S/C12H15N3/c1-10-12(4-3-6-13-10)14-8-11-5-7-15(2)9-11/h3-7,9,14H,8H2,1-2H3
InChIKeyALIGDHAOOIOOBA-UHFFFAOYSA-N
XLogP2.34
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine
CID 66397464
3-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-2-amine
CID 115867856
2-methyl-N-[(4-methylphenyl)methyl]pyridin-3-amine
CID 79041910
1,3-dimethyl-N-[(1-methylpyrrol-3-yl)methyl]pyrazol-4-amine
CID 104954401
2-methyl-N-(pyridin-3-ylmethyl)pyridin-3-amine
CID 75356077
N-[(1-methylpyrrol-3-yl)methyl]-2-methylsulfanylaniline
CID 66400207
2-methyl-N-(naphthalen-2-ylmethyl)pyridin-3-amine
CID 79042132
N-[(1-ethylimidazol-2-yl)methyl]-2-methylpyridin-3-amine
CID 79041847
N-[(6-chloro-3-pyridinyl)methyl]-2-methylpyridin-3-amine
CID 115748626
2-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyridin-3-amine
CID 79042080
4-[[(2-methyl-3-pyridinyl)amino]methyl]benzonitrile
CID 79041711
2,6-difluoro-4-[[(2-methyl-3-pyridinyl)amino]methyl]phenol
CID 79892131

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine?
The IUPAC name of 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine (CID 79041862) is 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine?
The canonical SMILES for 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine is Cc1ncccc1NCc1ccn(C)c1.
What is the InChIKey of 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine?
The InChIKey is ALIGDHAOOIOOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-10-12(4-3-6-13-10)14-8-11-5-7-15(2)9-11/h3-7,9,14H,8H2,1-2H3.
What are the key properties of 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine?
2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine has a molecular weight of 201.27 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 79041862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).