3-(aminomethyl)benzamide

C8H10N2O — CID 10103327

IUPAC3-(aminomethyl)benzamide
SMILESNCc1cccc(C(N)=O)c1
InChIInChI=1S/C8H10N2O/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5,9H2,(H2,10,11)
InChIKeyHYHLWVJLJXARGY-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.24
Rot. Bonds2

About 3-(aminomethyl)benzamide

3-(aminomethyl)benzamide (PubChem CID 10103327) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-(aminomethyl)benzamide.

Molecular Properties

Compound Name3-(aminomethyl)benzamide
PubChem CID10103327
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name3-(aminomethyl)benzamide
SMILESNCc1cccc(C(N)=O)c1
InChIInChI=1S/C8H10N2O/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5,9H2,(H2,10,11)
InChIKeyHYHLWVJLJXARGY-UHFFFAOYSA-N
XLogP0.24
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Benzamide
CID 2331
N-Methylbenzamide
CID 11954
Phthalamide
CID 6956
4-Fluorobenzamide
CID 71572
Isophthalyl dihydrazide
CID 72700
4-Methylbenzamide
CID 69274
2-Methylbenzamide
CID 10704
Carboxycinnamic Acid Bishydroxamide
CID 5353484
2-Fluorobenzamide
CID 67964
4-Iodobenzamide
CID 77561
Terephthalamide
CID 76381
m-Toluamide
CID 69253

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)benzamide?
The IUPAC name of 3-(aminomethyl)benzamide (CID 10103327) is 3-(aminomethyl)benzamide.
What is the SMILES notation for 3-(aminomethyl)benzamide?
The canonical SMILES for 3-(aminomethyl)benzamide is NCc1cccc(C(N)=O)c1.
What is the InChIKey of 3-(aminomethyl)benzamide?
The InChIKey is HYHLWVJLJXARGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,5,9H2,(H2,10,11).
What are the key properties of 3-(aminomethyl)benzamide?
3-(aminomethyl)benzamide has a molecular weight of 150.18 g/mol, XLogP of 0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)benzamide is sourced from PubChem (CID 10103327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).