N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide

C9H14F2N2O — CID 122269485

IUPACN-cyclopentyl-3,3-difluoroazetidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CC(F)(F)C1
InChIInChI=1S/C9H14F2N2O/c10-9(11)5-13(6-9)8(14)12-7-3-1-2-4-7/h7H,1-6H2,(H,12,14)
InChIKeyACWRSUYDZXDAPK-UHFFFAOYSA-N
MW204.22 g/mol
LogP1.59
Rot. Bonds1

About N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide

N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide (PubChem CID 122269485) has the molecular formula C9H14F2N2O and a molecular weight of 204.22 g/mol. Its IUPAC name is N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3,3-difluoroazetidine-1-carboxamide
PubChem CID122269485
Molecular FormulaC9H14F2N2O
Molecular Weight204.22 g/mol
Exact Mass204.11
IUPAC NameN-cyclopentyl-3,3-difluoroazetidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CC(F)(F)C1
InChIInChI=1S/C9H14F2N2O/c10-9(11)5-13(6-9)8(14)12-7-3-1-2-4-7/h7H,1-6H2,(H,12,14)
InChIKeyACWRSUYDZXDAPK-UHFFFAOYSA-N
XLogP1.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.22
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Cyclopentyl-3-(trifluoromethyl)urea
CID 21511698
(3,3-Difluorocyclopentyl)urea
CID 88975015
3,3-difluoro-N-isopropylazetidine-1-carboxamide
CID 122269482
(3,3-Difluoroazetidin-1-yl)-[2-[3-(ethylamino)propyl]pyrrolidin-1-yl]methanone
CID 123913294
[(1R)-3,3-difluorocyclopentyl]urea
CID 140633335
3-(3-Aminocyclopentyl)-1-methyl-1-(2,2,2-trifluoroethyl)urea
CID 147779155
N-[(2R)-butan-2-yl]-3,3-difluoroazetidine-1-carboxamide
CID 167134973
2-(cyanomethyl)-N-(1,1,1-trifluoropropan-2-yl)azetidine-1-carboxamide
CID 178181153
1-Cyclopentyl-3-(4,4,4-trifluorobutan-2-yl)urea
CID 104854738
1-Cyclopentyl-3-(2,2,3,3-tetrafluoropropyl)urea
CID 106291082
1-(2-Aminoethyl)-3-cyclopentyl-1-(2,2-difluoroethyl)urea
CID 107493756
1-(2-Aminoethyl)-3-cyclopentyl-1-(2,2,2-trifluoroethyl)urea
CID 107493788

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide (CID 122269485) is N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide is O=C(NC1CCCC1)N1CC(F)(F)C1.
What is the InChIKey of N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide?
The InChIKey is ACWRSUYDZXDAPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F2N2O/c10-9(11)5-13(6-9)8(14)12-7-3-1-2-4-7/h7H,1-6H2,(H,12,14).
What are the key properties of N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide?
N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide has a molecular weight of 204.22 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3,3-difluoroazetidine-1-carboxamide is sourced from PubChem (CID 122269485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).