N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide

C10H18F2N2O2 — CID 107485046

IUPACN-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide
SMILESO=C(CCN(CCO)CC(F)F)NC1CC1
InChIInChI=1S/C10H18F2N2O2/c11-9(12)7-14(5-6-15)4-3-10(16)13-8-1-2-8/h8-9,15H,1-7H2,(H,13,16)
InChIKeyQOTCVADNSIVFDV-UHFFFAOYSA-N
MW236.26 g/mol
LogP0.21
Rot. Bonds8

About N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide

N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide (PubChem CID 107485046) has the molecular formula C10H18F2N2O2 and a molecular weight of 236.26 g/mol. Its IUPAC name is N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide
PubChem CID107485046
Molecular FormulaC10H18F2N2O2
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC NameN-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide
SMILESO=C(CCN(CCO)CC(F)F)NC1CC1
InChIInChI=1S/C10H18F2N2O2/c11-9(12)7-14(5-6-15)4-3-10(16)13-8-1-2-8/h8-9,15H,1-7H2,(H,13,16)
InChIKeyQOTCVADNSIVFDV-UHFFFAOYSA-N
XLogP0.21
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide (CID 107485046) is N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide is O=C(CCN(CCO)CC(F)F)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide?
The InChIKey is QOTCVADNSIVFDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O2/c11-9(12)7-14(5-6-15)4-3-10(16)13-8-1-2-8/h8-9,15H,1-7H2,(H,13,16).
What are the key properties of N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide?
N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide has a molecular weight of 236.26 g/mol, XLogP of 0.21, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[2,2-difluoroethyl(2-hydroxyethyl)amino]propanamide is sourced from PubChem (CID 107485046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).