N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide

C17H20N2O2 — CID 28755644

IUPACN-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccc(CC(=O)N(C)c2ccc(CN)cc2)cc1
InChIInChI=1S/C17H20N2O2/c1-19(15-7-3-14(12-18)4-8-15)17(20)11-13-5-9-16(21-2)10-6-13/h3-10H,11-12,18H2,1-2H3
InChIKeyMPMANMNRSCPOIT-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.36
Rot. Bonds5

About N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide

N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide (PubChem CID 28755644) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide
PubChem CID28755644
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccc(CC(=O)N(C)c2ccc(CN)cc2)cc1
InChIInChI=1S/C17H20N2O2/c1-19(15-7-3-14(12-18)4-8-15)17(20)11-13-5-9-16(21-2)10-6-13/h3-10H,11-12,18H2,1-2H3
InChIKeyMPMANMNRSCPOIT-UHFFFAOYSA-N
XLogP2.36
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107027641
N-[4-(aminomethyl)phenyl]-N-methyl-2-phenylacetamide
CID 28755638
2-[4-(aminomethyl)phenyl]-N-methyl-N-(4-methylphenyl)acetamide
CID 63590516
N-(4-methoxyphenyl)-N-methyl-2-pyridin-4-ylacetamide
CID 110468130
2-chloro-N-(4-methoxyphenyl)-N-methylacetamide
CID 4714233
N-[4-(aminomethyl)phenyl]-2-ethoxy-N-methylacetamide
CID 43275430
N-[4-(aminomethyl)phenyl]-3-methoxy-N,3-dimethylbutanamide
CID 103017349
N-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605370
N-(4-methoxyphenyl)-N-methyl-3-(4-methylphenyl)propanamide
CID 172554773
N-(3-methoxyphenyl)-N-methyl-2-(4-sulfanylphenyl)acetamide
CID 107027625
N-[4-(aminomethyl)phenyl]-N,2-dimethylpropanamide
CID 28755580
N-(2-hydroxypropyl)-2-(4-methoxyphenyl)-N-methylacetamide
CID 62333656

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide (CID 28755644) is N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide is COc1ccc(CC(=O)N(C)c2ccc(CN)cc2)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide?
The InChIKey is MPMANMNRSCPOIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-19(15-7-3-14(12-18)4-8-15)17(20)11-13-5-9-16(21-2)10-6-13/h3-10H,11-12,18H2,1-2H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide?
N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide has a molecular weight of 284.36 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2-(4-methoxyphenyl)-N-methylacetamide is sourced from PubChem (CID 28755644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).