3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide

C19H20FN3O2 — CID 119740426

IUPAC3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide
SMILESO=C(CNCC1CC1)Nc1cccc(C(=O)Nc2cccc(F)c2)c1
InChIInChI=1S/C19H20FN3O2/c20-15-4-2-6-17(10-15)23-19(25)14-3-1-5-16(9-14)22-18(24)12-21-11-13-7-8-13/h1-6,9-10,13,21H,7-8,11-12H2,(H,22,24)(H,23,25)
InChIKeyLTCVFJQYXIIFTA-UHFFFAOYSA-N
MW341.39 g/mol
LogP3.02
Rot. Bonds7

About 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide

3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide (PubChem CID 119740426) has the molecular formula C19H20FN3O2 and a molecular weight of 341.39 g/mol. Its IUPAC name is 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide.

Molecular Properties

Compound Name3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide
PubChem CID119740426
Molecular FormulaC19H20FN3O2
Molecular Weight341.39 g/mol
Exact Mass341.15
IUPAC Name3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide
SMILESO=C(CNCC1CC1)Nc1cccc(C(=O)Nc2cccc(F)c2)c1
InChIInChI=1S/C19H20FN3O2/c20-15-4-2-6-17(10-15)23-19(25)14-3-1-5-16(9-14)22-18(24)12-21-11-13-7-8-13/h1-6,9-10,13,21H,7-8,11-12H2,(H,22,24)(H,23,25)
InChIKeyLTCVFJQYXIIFTA-UHFFFAOYSA-N
XLogP3.02
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)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

2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
CID 28566886
2-(cyclobutylmethylamino)-N-(3-fluorophenyl)acetamide
CID 43298672
2-(cyclopropylmethylamino)-1-(3-fluorophenyl)ethanone
CID 116557703
3-acetamido-N-(3-fluorophenyl)benzamide
CID 2443243
N'-[3-[(3-fluorophenyl)carbamoyl]phenyl]hexanediamide
CID 86817394
2-(cyclopropylmethylamino)-N-[3-(difluoromethyl)phenyl]acetamide;hydrochloride
CID 119767750
N-(3-bromophenyl)-2-[(4-hydroxycyclohexyl)methylamino]acetamide
CID 106133334
3,4-diethoxy-N-[2-[3-[(3-fluorophenyl)carbamoyl]anilino]-2-oxoethyl]benzamide
CID 55946843
N-(3-fluorophenyl)-3-(3-piperidin-4-ylbutanoylamino)benzamide
CID 119740430
2-(cyclopropylmethylamino)-N-[3-fluoro-4-[(3-fluorophenyl)methoxy]phenyl]acetamide
CID 119773636
N-[3-[(3-fluorophenyl)carbamoyl]phenyl]piperidine-4-carboxamide
CID 119298680
3-[(3-aminocyclopentanecarbonyl)amino]-N-(3-fluorophenyl)benzamide
CID 119740416

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide?
The IUPAC name of 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide (CID 119740426) is 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide.
What is the SMILES notation for 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide?
The canonical SMILES for 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide is O=C(CNCC1CC1)Nc1cccc(C(=O)Nc2cccc(F)c2)c1.
What is the InChIKey of 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide?
The InChIKey is LTCVFJQYXIIFTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O2/c20-15-4-2-6-17(10-15)23-19(25)14-3-1-5-16(9-14)22-18(24)12-21-11-13-7-8-13/h1-6,9-10,13,21H,7-8,11-12H2,(H,22,24)(H,23,25).
What are the key properties of 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide?
3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide has a molecular weight of 341.39 g/mol, XLogP of 3.02, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-(3-fluorophenyl)benzamide is sourced from PubChem (CID 119740426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).