2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide

C25H27ClN2O2 — CID 3818075

IUPAC2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide
SMILESO=C(c1ccccc1Cl)N(CCCN1CCOCC1)Cc1cccc2ccccc12
InChIInChI=1S/C25H27ClN2O2/c26-24-12-4-3-11-23(24)25(29)28(14-6-13-27-15-17-30-18-16-27)19-21-9-5-8-20-7-1-2-10-22(20)21/h1-5,7-12H,6,13-19H2
InChIKeyRFYHXLHWNCKSHK-UHFFFAOYSA-N
MW422.96 g/mol
LogP4.86
Rot. Bonds7

About 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide

2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide (PubChem CID 3818075) has the molecular formula C25H27ClN2O2 and a molecular weight of 422.96 g/mol. Its IUPAC name is 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide
PubChem CID3818075
Molecular FormulaC25H27ClN2O2
Molecular Weight422.96 g/mol
Exact Mass422.18
IUPAC Name2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide
SMILESO=C(c1ccccc1Cl)N(CCCN1CCOCC1)Cc1cccc2ccccc12
InChIInChI=1S/C25H27ClN2O2/c26-24-12-4-3-11-23(24)25(29)28(14-6-13-27-15-17-30-18-16-27)19-21-9-5-8-20-7-1-2-10-22(20)21/h1-5,7-12H,6,13-19H2
InChIKeyRFYHXLHWNCKSHK-UHFFFAOYSA-N
XLogP4.86
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.96
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)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-(2-morpholin-4-ylethyl)-N-(naphthalen-1-ylmethyl)morpholine-4-carboxamide
CID 3807765
N-[(2,3-dimethoxyphenyl)methyl]-2-fluoro-N-(3-morpholin-4-ylpropyl)benzamide
CID 4552747
N-[(2-chlorophenyl)methyl]-N-(3-morpholin-4-ylpropyl)cyclopentanecarboxamide
CID 42701433
1-[[4-[(benzylamino)methyl]phenyl]methyl]-1-(3-morpholin-4-ylpropyl)-3-(naphthalen-1-ylmethyl)urea
CID 59826221
1-[2-(dimethylamino)ethyl]-3-(3-morpholin-4-ylpropyl)-1-(naphthalen-1-ylmethyl)thiourea
CID 20628304
N-(2-morpholin-4-ylethyl)-N-(thiophen-3-ylmethyl)naphthalene-1-carboxamide
CID 42704234
2-chloro-N-(2-morpholin-4-ylethyl)-N-[(4-phenylmethoxyphenyl)methyl]benzamide
CID 42698238
N-[2-[(4-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-oxoethyl]-N-(3-morpholin-4-ylpropyl)naphthalene-1-carboxamide
CID 42773435
methyl 4-[[(2-chlorophenyl)methyl-(3-morpholin-4-ylpropyl)carbamothioyl]amino]benzoate
CID 44668843
2-chloro-N-[(9-ethylcarbazol-3-yl)methyl]-N-(3-morpholin-4-ylpropyl)-4-nitrobenzamide
CID 42701344
N-[2-[acetyl(2-morpholin-4-ylethyl)amino]ethyl]-2-chlorobenzamide
CID 113053679
N-(2-cyanoethyl)-N-(2-morpholin-4-ylethyl)-2-naphthalen-1-ylacetamide
CID 60520082

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide?
The IUPAC name of 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide (CID 3818075) is 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide is O=C(c1ccccc1Cl)N(CCCN1CCOCC1)Cc1cccc2ccccc12.
What is the InChIKey of 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide?
The InChIKey is RFYHXLHWNCKSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27ClN2O2/c26-24-12-4-3-11-23(24)25(29)28(14-6-13-27-15-17-30-18-16-27)19-21-9-5-8-20-7-1-2-10-22(20)21/h1-5,7-12H,6,13-19H2.
What are the key properties of 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide?
2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide has a molecular weight of 422.96 g/mol, XLogP of 4.86, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-morpholin-4-ylpropyl)-N-(naphthalen-1-ylmethyl)benzamide is sourced from PubChem (CID 3818075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).