N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide

C19H22N2O3 — CID 60608621

IUPACN-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide
SMILESCOCc1ccc(C(=O)NCCC(=O)NCc2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-24-14-16-7-9-17(10-8-16)19(23)20-12-11-18(22)21-13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,20,23)(H,21,22)
InChIKeyPEVTYRSUJGADOF-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.27
Rot. Bonds8

About N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide

N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide (PubChem CID 60608621) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide
PubChem CID60608621
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide
SMILESCOCc1ccc(C(=O)NCCC(=O)NCc2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-24-14-16-7-9-17(10-8-16)19(23)20-12-11-18(22)21-13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,20,23)(H,21,22)
InChIKeyPEVTYRSUJGADOF-UHFFFAOYSA-N
XLogP2.27
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[[4-(2-methoxyethoxy)phenyl]methylamino]-3-oxopropyl]benzamide
CID 55662715
N-[4-[[3-(methoxymethyl)phenyl]methylamino]-4-oxobutyl]benzamide
CID 46487585
N-[3-oxo-3-[[3-(phenylmethoxymethyl)phenyl]methylamino]propyl]benzamide
CID 46465050
N-ethyl-4-[[[4-(methoxymethyl)benzoyl]amino]methyl]benzamide
CID 86990014
N-[3-[[4-(diethylaminomethyl)phenyl]methylamino]-3-oxopropyl]benzamide
CID 46655947
N-[3-[(6-methoxy-3-pyridinyl)methylamino]-3-oxopropyl]benzamide
CID 16602215
N-[3-[[4-(difluoromethoxy)phenyl]methylamino]-3-oxopropyl]benzamide
CID 24644344
N-benzyl-4-[2-[4-[[[4-(benzylamino)-4-oxobutanoyl]amino]carbamoyl]benzoyl]hydrazinyl]-4-oxobutanamide
CID 3359263
4-(methoxymethyl)-N-[2-(methylamino)ethyl]benzamide
CID 119503363
4-amino-N-[3-[(4-hydroxyphenyl)methylamino]-3-oxopropyl]benzamide
CID 166202390
methyl 4-[(3-anilinopropanoylamino)methyl]benzoate
CID 37251734
N-[[4-(methoxymethyl)phenyl]methyl]-4-pyrrol-1-ylbenzamide
CID 46448239

Frequently Asked Questions

What is the IUPAC name of N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide?
The IUPAC name of N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide (CID 60608621) is N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide.
What is the SMILES notation for N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide?
The canonical SMILES for N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide is COCc1ccc(C(=O)NCCC(=O)NCc2ccccc2)cc1.
What is the InChIKey of N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide?
The InChIKey is PEVTYRSUJGADOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-24-14-16-7-9-17(10-8-16)19(23)20-12-11-18(22)21-13-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,20,23)(H,21,22).
What are the key properties of N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide?
N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide has a molecular weight of 326.40 g/mol, XLogP of 2.27, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(benzylamino)-3-oxopropyl]-4-(methoxymethyl)benzamide is sourced from PubChem (CID 60608621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).