2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide

C14H17F2NO3 — CID 86846916

IUPAC2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
SMILESCC(OCC1CC1)C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C14H17F2NO3/c1-9(19-8-10-6-7-10)13(18)17-11-4-2-3-5-12(11)20-14(15)16/h2-5,9-10,14H,6-8H2,1H3,(H,17,18)
InChIKeyKKSZNOJFRKEWQR-UHFFFAOYSA-N
MW285.29 g/mol
LogP3.04
Rot. Bonds7

About 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide

2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide (PubChem CID 86846916) has the molecular formula C14H17F2NO3 and a molecular weight of 285.29 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
PubChem CID86846916
Molecular FormulaC14H17F2NO3
Molecular Weight285.29 g/mol
Exact Mass285.12
IUPAC Name2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
SMILESCC(OCC1CC1)C(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C14H17F2NO3/c1-9(19-8-10-6-7-10)13(18)17-11-4-2-3-5-12(11)20-14(15)16/h2-5,9-10,14H,6-8H2,1H3,(H,17,18)
InChIKeyKKSZNOJFRKEWQR-UHFFFAOYSA-N
XLogP3.04
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.29
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 48530161
N-(2-cyanophenyl)-2-(cyclopropylmethoxy)propanamide
CID 43188643
(2S)-2-amino-N-[2-(difluoromethoxy)phenyl]propanamide
CID 61147422
(2S)-2-[[(2S)-oxolan-2-yl]methoxy]-N-(2-propan-2-yloxyphenyl)propanamide
CID 94823131
(2S)-2-[[(2R)-oxolan-2-yl]methoxy]-N-(2-propan-2-yloxyphenyl)propanamide
CID 94823133
2-(azetidin-3-yl)-N-[2-(difluoromethoxy)phenyl]propanamide
CID 116674736
2-amino-N-[2-(difluoromethoxy)phenyl]-3-methylbutanamide
CID 43146665
N-[2-(difluoromethoxy)phenyl]-2-(4-hydroxypiperidin-1-yl)propanamide
CID 51243860
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] adamantane-1-carboxylate
CID 55417583
4-[(2R)-1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl]oxybenzamide
CID 8946649
[1-[2-(difluoromethoxy)anilino]-1-oxopropan-2-yl] 4-(hydroxymethyl)benzoate
CID 46630049
N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66323873

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide?
The IUPAC name of 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide (CID 86846916) is 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide.
What is the SMILES notation for 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide?
The canonical SMILES for 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide is CC(OCC1CC1)C(=O)Nc1ccccc1OC(F)F.
What is the InChIKey of 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide?
The InChIKey is KKSZNOJFRKEWQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2NO3/c1-9(19-8-10-6-7-10)13(18)17-11-4-2-3-5-12(11)20-14(15)16/h2-5,9-10,14H,6-8H2,1H3,(H,17,18).
What are the key properties of 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide?
2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide has a molecular weight of 285.29 g/mol, XLogP of 3.04, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide is sourced from PubChem (CID 86846916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).