N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide

C9H14FNO2 — CID 131155439

IUPACN-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide
SMILESCN(C(=O)C1(F)CCOC1)C1CC1
InChIInChI=1S/C9H14FNO2/c1-11(7-2-3-7)8(12)9(10)4-5-13-6-9/h7H,2-6H2,1H3
InChIKeyKKPFRHAHUPRHTB-UHFFFAOYSA-N
MW187.21 g/mol
LogP0.74
Rot. Bonds2

About N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide

N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide (PubChem CID 131155439) has the molecular formula C9H14FNO2 and a molecular weight of 187.21 g/mol. Its IUPAC name is N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide
PubChem CID131155439
Molecular FormulaC9H14FNO2
Molecular Weight187.21 g/mol
Exact Mass187.10
IUPAC NameN-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide
SMILESCN(C(=O)C1(F)CCOC1)C1CC1
InChIInChI=1S/C9H14FNO2/c1-11(7-2-3-7)8(12)9(10)4-5-13-6-9/h7H,2-6H2,1H3
InChIKeyKKPFRHAHUPRHTB-UHFFFAOYSA-N
XLogP0.74
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluorooxolane-3-carboxamide
CID 131131789
4-amino-N-cycloheptyl-N-methyloxane-4-carboxamide
CID 115293762
N-cyclopropyl-2-[(3-methoxyoxolan-3-yl)methylamino]-N-methylacetamide
CID 104760856
N-cyclopropyl-1-(N'-hydroxycarbamimidoyl)-N-methylcyclobutane-1-carboxamide
CID 80597435
4-[[cyclopropyl(methyl)carbamoyl]amino]oxane-4-carboxylic acid
CID 115292842
N-cyclopropyl-1-(N'-hydroxycarbamimidoyl)-N-methylcycloheptane-1-carboxamide
CID 76919966
1-(4-fluorooxan-4-yl)ethanone
CID 58356077
3-[[methyl(oxan-4-yl)carbamoyl]amino]oxolane-3-carboxylic acid
CID 64893257
3-amino-N-methyl-N-(1-methylpiperidin-3-yl)oxolane-3-carboxamide
CID 64892393
4-amino-N,3-dimethyl-N-(oxan-4-yl)oxolane-3-carboxamide
CID 66250019
1-[cyclohexyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62095220
N,3-dimethyl-N-(oxan-4-yl)pyrrolidine-3-carboxamide
CID 63139219

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide?
The IUPAC name of N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide (CID 131155439) is N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide?
The canonical SMILES for N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide is CN(C(=O)C1(F)CCOC1)C1CC1.
What is the InChIKey of N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide?
The InChIKey is KKPFRHAHUPRHTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FNO2/c1-11(7-2-3-7)8(12)9(10)4-5-13-6-9/h7H,2-6H2,1H3.
What are the key properties of N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide?
N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide has a molecular weight of 187.21 g/mol, XLogP of 0.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-fluoro-N-methyloxolane-3-carboxamide is sourced from PubChem (CID 131155439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).