N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide

C15H15ClN2O2 — CID 64882519

IUPACN-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)Nc1ccccc1CN
InChIInChI=1S/C15H15ClN2O2/c1-20-14-8-11(16)6-7-12(14)15(19)18-13-5-3-2-4-10(13)9-17/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyVJPZEUQIQHKGBF-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.06
Rot. Bonds4

About N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide

N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide (PubChem CID 64882519) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide
PubChem CID64882519
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide
SMILESCOc1cc(Cl)ccc1C(=O)Nc1ccccc1CN
InChIInChI=1S/C15H15ClN2O2/c1-20-14-8-11(16)6-7-12(14)15(19)18-13-5-3-2-4-10(13)9-17/h2-8H,9,17H2,1H3,(H,18,19)
InChIKeyVJPZEUQIQHKGBF-UHFFFAOYSA-N
XLogP3.06
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[2-(chloromethyl)phenyl]-2-methoxybenzamide
CID 114298257
4-chloro-N-(2-chloro-3-pyridinyl)-2-methoxybenzamide
CID 103721934
4-bromo-N-(2-ethylphenyl)-2-methoxybenzamide
CID 78987528
N-(5-amino-2,4-dimethylphenyl)-4-chloro-2-methoxybenzamide
CID 104756975
N-(5-chloro-2-fluorophenyl)-2-methoxybenzamide
CID 8759235
4-chloro-N-(4-iodophenyl)-2-methoxybenzamide
CID 47421842
N-[2-(aminomethyl)phenyl]-2,4-dimethylbenzamide
CID 16772806
N-[2-(aminomethyl)phenyl]-2-chloro-5-hydroxybenzamide
CID 106502622
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
1-[2-(aminomethyl)phenyl]-3-(2,5-dichlorophenyl)urea
CID 64895840
4-chloro-N-(2-methoxyphenyl)-2-nitrobenzamide
CID 789181
4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide
CID 17257106

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide (CID 64882519) is N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide is COc1cc(Cl)ccc1C(=O)Nc1ccccc1CN.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide?
The InChIKey is VJPZEUQIQHKGBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-20-14-8-11(16)6-7-12(14)15(19)18-13-5-3-2-4-10(13)9-17/h2-8H,9,17H2,1H3,(H,18,19).
What are the key properties of N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide?
N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide has a molecular weight of 290.75 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-4-chloro-2-methoxybenzamide is sourced from PubChem (CID 64882519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).