2-(aminomethyl)-N,4-dimethylaniline

C9H14N2 — CID 82502533

IUPAC2-(aminomethyl)-N,4-dimethylaniline
SMILESCNc1ccc(C)cc1CN
InChIInChI=1S/C9H14N2/c1-7-3-4-9(11-2)8(5-7)6-10/h3-5,11H,6,10H2,1-2H3
InChIKeyYIXJXONSSXLOCQ-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.50
Rot. Bonds2

About 2-(aminomethyl)-N,4-dimethylaniline

2-(aminomethyl)-N,4-dimethylaniline (PubChem CID 82502533) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-(aminomethyl)-N,4-dimethylaniline.

Molecular Properties

Compound Name2-(aminomethyl)-N,4-dimethylaniline
PubChem CID82502533
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name2-(aminomethyl)-N,4-dimethylaniline
SMILESCNc1ccc(C)cc1CN
InChIInChI=1S/C9H14N2/c1-7-3-4-9(11-2)8(5-7)6-10/h3-5,11H,6,10H2,1-2H3
InChIKeyYIXJXONSSXLOCQ-UHFFFAOYSA-N
XLogP1.50
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)-4-methylphenyl]-2-methylpropanamide
CID 82507184
3-[5-methyl-2-(methylamino)phenyl]propanoic acid
CID 20546910
2-hydrazinyl-N,5-dimethylaniline
CID 149056718
N,2,4-trimethylaniline;hydrochloride
CID 18686602
(2-fluoro-5-methylphenyl)methanamine;hydrochloride
CID 117064774
1-N,4-dimethylbenzene-1,2-diamine;ethane;molecular hydrogen
CID 144996884
2-[2-(aminomethyl)-4-methylanilino]-3-phenylpropan-1-ol
CID 107926215
(5-methyl-2-methylsulfanylphenyl)methanamine;hydrochloride
CID 66876860
(2,4-dimethylphenyl)methanamine;propane
CID 143780972
(2-cyclopropyl-5-methylphenyl)methanamine
CID 90236498
2-[[3-chloro-4-(methylamino)phenyl]methyl]-4-methylphenol
CID 132570110
2-chloro-N,4-dimethylaniline;formaldehyde
CID 177231502

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,4-dimethylaniline?
The IUPAC name of 2-(aminomethyl)-N,4-dimethylaniline (CID 82502533) is 2-(aminomethyl)-N,4-dimethylaniline.
What is the SMILES notation for 2-(aminomethyl)-N,4-dimethylaniline?
The canonical SMILES for 2-(aminomethyl)-N,4-dimethylaniline is CNc1ccc(C)cc1CN.
What is the InChIKey of 2-(aminomethyl)-N,4-dimethylaniline?
The InChIKey is YIXJXONSSXLOCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7-3-4-9(11-2)8(5-7)6-10/h3-5,11H,6,10H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N,4-dimethylaniline?
2-(aminomethyl)-N,4-dimethylaniline has a molecular weight of 150.22 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,4-dimethylaniline is sourced from PubChem (CID 82502533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).