N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide

C17H20N2O2 — CID 28661894

IUPACN-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NCc2cccc(OC)c2)c1
InChIInChI=1S/C17H20N2O2/c1-3-17(20)19-15-8-5-7-14(11-15)18-12-13-6-4-9-16(10-13)21-2/h4-11,18H,3,12H2,1-2H3,(H,19,20)
InChIKeyBKCXBUTXMPGASJ-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.66
Rot. Bonds6

About N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide

N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide (PubChem CID 28661894) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide.

Molecular Properties

Compound NameN-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide
PubChem CID28661894
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NCc2cccc(OC)c2)c1
InChIInChI=1S/C17H20N2O2/c1-3-17(20)19-15-8-5-7-14(11-15)18-12-13-6-4-9-16(10-13)21-2/h4-11,18H,3,12H2,1-2H3,(H,19,20)
InChIKeyBKCXBUTXMPGASJ-UHFFFAOYSA-N
XLogP3.66
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(4-methoxyanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54833198
N-[4-[[2-(3-methoxyanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54835583
3-[(3-methoxyphenyl)methylamino]-N-methylbenzamide
CID 28650224
N-[3-[(4-bromo-3-methylphenyl)methylamino]phenyl]propanamide
CID 66473184
2-(3-methoxyphenyl)-N-phenylacetamide
CID 2598681
N-(3-hydroxyphenyl)-2-(3-methoxyphenyl)acetamide
CID 28739724
N-[(3-methoxyphenyl)methyl]-3,4-dimethylaniline;oxalic acid
CID 17367859
N-[3-[(3-bromophenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43713051
N-[3-(bromomethyl)phenyl]-2-(3-methoxyphenyl)acetamide
CID 114307304
N-[(3-butoxyphenyl)methyl]-3-methoxyaniline
CID 39386916
N-[(3-methoxyphenyl)methyl]-3-methylsulfonylaniline
CID 60699405
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide?
The IUPAC name of N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide (CID 28661894) is N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide.
What is the SMILES notation for N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide?
The canonical SMILES for N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide is CCC(=O)Nc1cccc(NCc2cccc(OC)c2)c1.
What is the InChIKey of N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide?
The InChIKey is BKCXBUTXMPGASJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-17(20)19-15-8-5-7-14(11-15)18-12-13-6-4-9-16(10-13)21-2/h4-11,18H,3,12H2,1-2H3,(H,19,20).
What are the key properties of N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide?
N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide has a molecular weight of 284.36 g/mol, XLogP of 3.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-methoxyphenyl)methylamino]phenyl]propanamide is sourced from PubChem (CID 28661894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).