2-(aminomethyl)-N-methylaniline

C8H12N2 — CID 12655267

IUPAC2-(aminomethyl)-N-methylaniline
SMILESCNc1ccccc1CN
InChIInChI=1S/C8H12N2/c1-10-8-5-3-2-4-7(8)6-9/h2-5,10H,6,9H2,1H3
InChIKeyUCXUQHNEOWZPFT-UHFFFAOYSA-N
MW136.20 g/mol
LogP1.19
Rot. Bonds2

About 2-(aminomethyl)-N-methylaniline

2-(aminomethyl)-N-methylaniline (PubChem CID 12655267) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 2-(aminomethyl)-N-methylaniline.

Molecular Properties

Compound Name2-(aminomethyl)-N-methylaniline
PubChem CID12655267
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name2-(aminomethyl)-N-methylaniline
SMILESCNc1ccccc1CN
InChIInChI=1S/C8H12N2/c1-10-8-5-3-2-4-7(8)6-9/h2-5,10H,6,9H2,1H3
InChIKeyUCXUQHNEOWZPFT-UHFFFAOYSA-N
XLogP1.19
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-methylaniline?
The IUPAC name of 2-(aminomethyl)-N-methylaniline (CID 12655267) is 2-(aminomethyl)-N-methylaniline.
What is the SMILES notation for 2-(aminomethyl)-N-methylaniline?
The canonical SMILES for 2-(aminomethyl)-N-methylaniline is CNc1ccccc1CN.
What is the InChIKey of 2-(aminomethyl)-N-methylaniline?
The InChIKey is UCXUQHNEOWZPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-10-8-5-3-2-4-7(8)6-9/h2-5,10H,6,9H2,1H3.
What are the key properties of 2-(aminomethyl)-N-methylaniline?
2-(aminomethyl)-N-methylaniline has a molecular weight of 136.20 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-methylaniline is sourced from PubChem (CID 12655267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).