N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide

C19H22N2O2 — CID 17154440

IUPACN-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide
SMILESCCN(Cc1ccccc1)C(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C19H22N2O2/c1-2-21(15-16-9-5-3-6-10-16)18(22)13-14-20-19(23)17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3,(H,20,23)
InChIKeyJNIJVVAQIKEQEJ-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.86
Rot. Bonds7

About N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide

N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide (PubChem CID 17154440) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide.

Molecular Properties

Compound NameN-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide
PubChem CID17154440
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide
SMILESCCN(Cc1ccccc1)C(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C19H22N2O2/c1-2-21(15-16-9-5-3-6-10-16)18(22)13-14-20-19(23)17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3,(H,20,23)
InChIKeyJNIJVVAQIKEQEJ-UHFFFAOYSA-N
XLogP2.86
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[(3,4-dichlorophenyl)methyl-ethylamino]-3-oxopropyl]benzamide
CID 55916150
N-benzyl-N-ethyl-3-(propan-2-ylamino)propanamide
CID 60854868
N,N'-dibenzyl-N,N'-diethylpentanediamide
CID 68902262
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
3-N-benzyl-3-N-ethyl-1-N-propylbenzene-1,3-dicarboxamide
CID 109050312
N-benzyl-3-(butan-2-ylamino)-N-ethylpropanamide
CID 109013097
N-[3-[(4-bromophenyl)methyl-methylamino]-3-oxopropyl]benzamide
CID 30877774
N-benzyl-N-ethyl-3-[2-(2-fluorophenyl)ethylamino]propanamide
CID 109022875
N-[3-[ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]amino]-3-oxopropyl]benzamide
CID 27821642
N-[3-[[4-(diethylaminomethyl)phenyl]methylamino]-3-oxopropyl]benzamide
CID 46655947
N-[3-(diethylamino)-3-oxopropyl]-4-sulfanylbenzamide
CID 107034718
3-bromo-N-[3-(diethylamino)-3-oxopropyl]benzamide
CID 47267566

Frequently Asked Questions

What is the IUPAC name of N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide?
The IUPAC name of N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide (CID 17154440) is N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide.
What is the SMILES notation for N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide?
The canonical SMILES for N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide is CCN(Cc1ccccc1)C(=O)CCNC(=O)c1ccccc1.
What is the InChIKey of N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide?
The InChIKey is JNIJVVAQIKEQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-2-21(15-16-9-5-3-6-10-16)18(22)13-14-20-19(23)17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3,(H,20,23).
What are the key properties of N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide?
N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide has a molecular weight of 310.40 g/mol, XLogP of 2.86, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[benzyl(ethyl)amino]-3-oxopropyl]benzamide is sourced from PubChem (CID 17154440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).