2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide

C13H16F2N2O3 — CID 60841268

IUPAC2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide
SMILESCOc1ccc(OC(F)F)c(NC(=O)CNC2CC2)c1
InChIInChI=1S/C13H16F2N2O3/c1-19-9-4-5-11(20-13(14)15)10(6-9)17-12(18)7-16-8-2-3-8/h4-6,8,13,16H,2-3,7H2,1H3,(H,17,18)
InChIKeySUYDYIRVQPZFNV-UHFFFAOYSA-N
MW286.28 g/mol
LogP1.99
Rot. Bonds7

About 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide

2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide (PubChem CID 60841268) has the molecular formula C13H16F2N2O3 and a molecular weight of 286.28 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide
PubChem CID60841268
Molecular FormulaC13H16F2N2O3
Molecular Weight286.28 g/mol
Exact Mass286.11
IUPAC Name2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide
SMILESCOc1ccc(OC(F)F)c(NC(=O)CNC2CC2)c1
InChIInChI=1S/C13H16F2N2O3/c1-19-9-4-5-11(20-13(14)15)10(6-9)17-12(18)7-16-8-2-3-8/h4-6,8,13,16H,2-3,7H2,1H3,(H,17,18)
InChIKeySUYDYIRVQPZFNV-UHFFFAOYSA-N
XLogP1.99
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.28
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(difluoromethoxy)-5-methoxyphenyl]-2-(methylamino)acetamide;hydrochloride
CID 119715086
5-[2-(difluoromethoxy)-5-methoxyanilino]-5-oxopentanoic acid
CID 60940435
(3S)-N-[2-(difluoromethoxy)-5-methoxyphenyl]-3-[(3R)-piperidin-3-yl]butanamide
CID 99775759
(3R)-N-[2-(difluoromethoxy)-5-methoxyphenyl]-3-[(3R)-piperidin-3-yl]butanamide
CID 99775760
2-[4-(difluoromethoxy)anilino]-N-(2,5-dimethoxyphenyl)acetamide
CID 36585879
N-[2-(difluoromethoxy)-5-methoxyphenyl]piperidine-4-carboxamide
CID 43706019
N-[2-(difluoromethoxy)-5-methoxyphenyl]-2,2-dimethylpropanamide
CID 64593385
2-bromo-N-[2-(difluoromethoxy)-5-methoxyphenyl]propanamide
CID 107903735
N-cyclopropyl-N'-(2,5-dimethoxyphenyl)propanediamide
CID 108941097
4-[[2-(difluoromethoxy)-5-methoxyphenyl]methylamino]cyclohexane-1-carboxylic acid
CID 120509745
2-bromo-N-[2-(difluoromethoxy)-5-methoxyphenyl]butanamide
CID 62856668
N-cyclopropyl-2-[(5-methoxy-2-propan-2-yloxyphenyl)carbamoylamino]acetamide
CID 56803361

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide (CID 60841268) is 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide is COc1ccc(OC(F)F)c(NC(=O)CNC2CC2)c1.
What is the InChIKey of 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide?
The InChIKey is SUYDYIRVQPZFNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O3/c1-19-9-4-5-11(20-13(14)15)10(6-9)17-12(18)7-16-8-2-3-8/h4-6,8,13,16H,2-3,7H2,1H3,(H,17,18).
What are the key properties of 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide?
2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide has a molecular weight of 286.28 g/mol, XLogP of 1.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[2-(difluoromethoxy)-5-methoxyphenyl]acetamide is sourced from PubChem (CID 60841268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).