N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide

C10H18F2N2O2 — CID 70871182

IUPACN-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide
SMILESCCNC(CC(F)F)C(O)C(=O)NC1CC1
InChIInChI=1S/C10H18F2N2O2/c1-2-13-7(5-8(11)12)9(15)10(16)14-6-3-4-6/h6-9,13,15H,2-5H2,1H3,(H,14,16)
InChIKeyAQMZJRCAQMBRBG-UHFFFAOYSA-N
MW236.26 g/mol
LogP0.26
Rot. Bonds7

About N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide

N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide (PubChem CID 70871182) has the molecular formula C10H18F2N2O2 and a molecular weight of 236.26 g/mol. Its IUPAC name is N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide
PubChem CID70871182
Molecular FormulaC10H18F2N2O2
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC NameN-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide
SMILESCCNC(CC(F)F)C(O)C(=O)NC1CC1
InChIInChI=1S/C10H18F2N2O2/c1-2-13-7(5-8(11)12)9(15)10(16)14-6-3-4-6/h6-9,13,15H,2-5H2,1H3,(H,14,16)
InChIKeyAQMZJRCAQMBRBG-UHFFFAOYSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide?
The IUPAC name of N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide (CID 70871182) is N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide.
What is the SMILES notation for N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide?
The canonical SMILES for N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide is CCNC(CC(F)F)C(O)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide?
The InChIKey is AQMZJRCAQMBRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O2/c1-2-13-7(5-8(11)12)9(15)10(16)14-6-3-4-6/h6-9,13,15H,2-5H2,1H3,(H,14,16).
What are the key properties of N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide?
N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide has a molecular weight of 236.26 g/mol, XLogP of 0.26, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(ethylamino)-5,5-difluoro-2-hydroxypentanamide is sourced from PubChem (CID 70871182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).