N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide

C16H20FNO3 — CID 50949134

IUPACN-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESCCO[C@H]1COC[C@@H]1NC(=O)C1(c2ccccc2F)CC1
InChIInChI=1S/C16H20FNO3/c1-2-21-14-10-20-9-13(14)18-15(19)16(7-8-16)11-5-3-4-6-12(11)17/h3-6,13-14H,2,7-10H2,1H3,(H,18,19)/t13-,14-/m0/s1
InChIKeyRCSYYVWACXBNAO-KBPBESRZSA-N
MW293.34 g/mol
LogP1.78
Rot. Bonds5

About N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide

N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide (PubChem CID 50949134) has the molecular formula C16H20FNO3 and a molecular weight of 293.34 g/mol. Its IUPAC name is N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide
PubChem CID50949134
Molecular FormulaC16H20FNO3
Molecular Weight293.34 g/mol
Exact Mass293.14
IUPAC NameN-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESCCO[C@H]1COC[C@@H]1NC(=O)C1(c2ccccc2F)CC1
InChIInChI=1S/C16H20FNO3/c1-2-21-14-10-20-9-13(14)18-15(19)16(7-8-16)11-5-3-4-6-12(11)17/h3-6,13-14H,2,7-10H2,1H3,(H,18,19)/t13-,14-/m0/s1
InChIKeyRCSYYVWACXBNAO-KBPBESRZSA-N
XLogP1.78
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide 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-(4-fluorophenyl)-N-(oxolan-2-ylmethyl)acetamide
CID 3148058
2-(4-fluorophenyl)-N-(1-methoxypropan-2-yl)acetamide
CID 2915718
1-(4-fluorophenyl)-2,2-dimethyl-N-(4-morpholin-4-ylbutyl)cyclopropane-1-carboxamide
CID 134156722
(2R)-2-[4-(2-methylpropyl)phenyl]-N-(oxolan-3-yl)propanamide
CID 11471362
1-(4-fluorophenyl)-N-(3-isopropoxypropyl)cyclopropanecarboxamide
CID 45504920
2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide
CID 51075738
1-(4-fluorophenyl)-N-(3-hydroxy-4,4-dimethylpentyl)cyclopropanecarboxamide
CID 71787603
N-(oxolan-2-ylmethyl)-2-phenylbutanamide
CID 2890068
cis-(1S,2R)-2-(2,6-difluorophenyl)-N-[(2R)-4-[(2R)-oxolan-2-yl]butan-2-yl]cyclopropane-1-carboxamide
CID 129423977
8-(1-Phenylcyclopropanecarbonyl)-1-oxa-4,8-diazacycloundecan-5-one
CID 110201629
1-(2-fluorophenyl)-N-(1-morpholin-4-ylbutan-2-yl)cyclopropane-1-carboxamide
CID 16673958
N-(1,4-dioxaspiro[4.5]decan-2-ylmethyl)-1-(4-fluorophenyl)cyclopropanecarboxamide
CID 49748691

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide (CID 50949134) is N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide is CCO[C@H]1COC[C@@H]1NC(=O)C1(c2ccccc2F)CC1.
What is the InChIKey of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
The InChIKey is RCSYYVWACXBNAO-KBPBESRZSA-N. The full InChI is InChI=1S/C16H20FNO3/c1-2-21-14-10-20-9-13(14)18-15(19)16(7-8-16)11-5-3-4-6-12(11)17/h3-6,13-14H,2,7-10H2,1H3,(H,18,19)/t13-,14-/m0/s1.
What are the key properties of N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide?
N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide has a molecular weight of 293.34 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,4R)-4-ethoxyoxolan-3-yl]-1-(2-fluorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 50949134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).