N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide

C9H13F2NO — CID 131101773

IUPACN-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide
SMILESO=C(NC1CC1)C1CCCC1(F)F
InChIInChI=1S/C9H13F2NO/c10-9(11)5-1-2-7(9)8(13)12-6-3-4-6/h6-7H,1-5H2,(H,12,13)
InChIKeyHPOZHHYPWHXLOE-UHFFFAOYSA-N
MW189.20 g/mol
LogP1.70
Rot. Bonds2

About N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide

N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide (PubChem CID 131101773) has the molecular formula C9H13F2NO and a molecular weight of 189.20 g/mol. Its IUPAC name is N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide
PubChem CID131101773
Molecular FormulaC9H13F2NO
Molecular Weight189.20 g/mol
Exact Mass189.10
IUPAC NameN-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide
SMILESO=C(NC1CC1)C1CCCC1(F)F
InChIInChI=1S/C9H13F2NO/c10-9(11)5-1-2-7(9)8(13)12-6-3-4-6/h6-7H,1-5H2,(H,12,13)
InChIKeyHPOZHHYPWHXLOE-UHFFFAOYSA-N
XLogP1.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.20
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2,2-difluorocyclopentanecarbonyl)amino]acetic acid
CID 130636476
N-[1-(chloromethyl)cyclopropyl]-2,2-difluorocyclopentane-1-carboxamide
CID 131047751
N-cyclopropyl-2,2-dimethylcyclopropane-1-carboxamide
CID 103837193
2,2-dimethyl-N-(3-methylcyclopentyl)cyclopentane-1-carboxamide
CID 105190701
N-cyclopropylcycloheptanecarboxamide
CID 62778853
N-cyclopropylcyclohexanecarboxamide
CID 3412875
1-(2,2-difluorocyclohexyl)ethanone
CID 131187691
(1R)-2,2-difluorocycloheptane-1-carboxylic acid
CID 97297799
3-[(2,2-dimethylcyclopentanecarbonyl)amino]cyclopentane-1-carboxylic acid
CID 107175654
N-cyclopentyl-2,2-dimethylcyclopropane-1-carboxamide
CID 103837196
2,2-dichloro-N-cyclopentylcyclopropane-1-carboxamide
CID 78790788
[(1R,2S)-2-amino-3,3-difluorocyclohexyl]carbamic acid
CID 68779730

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide?
The IUPAC name of N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide (CID 131101773) is N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide?
The canonical SMILES for N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide is O=C(NC1CC1)C1CCCC1(F)F.
What is the InChIKey of N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide?
The InChIKey is HPOZHHYPWHXLOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F2NO/c10-9(11)5-1-2-7(9)8(13)12-6-3-4-6/h6-7H,1-5H2,(H,12,13).
What are the key properties of N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide?
N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide has a molecular weight of 189.20 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,2-difluorocyclopentane-1-carboxamide is sourced from PubChem (CID 131101773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).