N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide

C27H29N3O3 — CID 174090422

IUPACN-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide
SMILESO=C(NCCN1CCOCC1)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C27H29N3O3/c31-26(28-11-12-30-13-15-33-16-14-30)21-7-5-20(6-8-21)24-18-25(24)27(32)29-23-10-9-19-3-1-2-4-22(19)17-23/h1-10,17,24-25H,11-16,18H2,(H,28,31)(H,29,32)/t24-,25+/m0/s1
InChIKeyVETXBCGPZNPRJJ-LOSJGSFVSA-N
MW443.55 g/mol
LogP3.64
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide

N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide (PubChem CID 174090422) has the molecular formula C27H29N3O3 and a molecular weight of 443.55 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide
PubChem CID174090422
Molecular FormulaC27H29N3O3
Molecular Weight443.55 g/mol
Exact Mass443.22
IUPAC NameN-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide
SMILESO=C(NCCN1CCOCC1)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C27H29N3O3/c31-26(28-11-12-30-13-15-33-16-14-30)21-7-5-20(6-8-21)24-18-25(24)27(32)29-23-10-9-19-3-1-2-4-22(19)17-23/h1-10,17,24-25H,11-16,18H2,(H,28,31)(H,29,32)/t24-,25+/m0/s1
InChIKeyVETXBCGPZNPRJJ-LOSJGSFVSA-N
XLogP3.64
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.55
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]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

4-(cyclobutanecarbonylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 48581633
(2S,4S)-2-methyl-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 120645418
trans-(1S,2S)-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-2-phenylcyclopropane-1-carboxamide
CID 97081561
cis-(1R,2S)-N-[3-(morpholin-4-ylmethyl)phenyl]-2-phenylcyclopropane-1-carboxamide
CID 51699063
6-methyl-N-(2-morpholin-4-ylethyl)naphthalene-2-carboxamide
CID 142825868
4-[(3-aminocyclohexanecarbonyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 119865091
4-[(1R)-2-(isoquinolin-6-ylcarbamoyl)cyclopropyl]-N-(pyridin-3-ylmethyl)benzamide
CID 155370478
4-[(4-chlorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 48581606
4-(ethylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 62166054
3-fluoro-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 48581644
trans-(1S,2S)-2-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 96564727
cis-(1R,2S)-2-(3,5-dichlorophenyl)-N-(2-morpholin-4-ylethyl)cyclopropane-1-carboxamide
CID 96564729

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide (CID 174090422) is N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide is O=C(NCCN1CCOCC1)c1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide?
The InChIKey is VETXBCGPZNPRJJ-LOSJGSFVSA-N. The full InChI is InChI=1S/C27H29N3O3/c31-26(28-11-12-30-13-15-33-16-14-30)21-7-5-20(6-8-21)24-18-25(24)27(32)29-23-10-9-19-3-1-2-4-22(19)17-23/h1-10,17,24-25H,11-16,18H2,(H,28,31)(H,29,32)/t24-,25+/m0/s1.
What are the key properties of N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide?
N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide has a molecular weight of 443.55 g/mol, XLogP of 3.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-4-[(1R,2R)-2-(naphthalen-2-ylcarbamoyl)cyclopropyl]benzamide is sourced from PubChem (CID 174090422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).