N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide

C6H8F3NO — CID 141350813

IUPACN-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide
SMILESCN(C=O)C1(C(F)(F)F)CC1
InChIInChI=1S/C6H8F3NO/c1-10(4-11)5(2-3-5)6(7,8)9/h4H,2-3H2,1H3
InChIKeyRKYDQCFXXXVLIV-UHFFFAOYSA-N
MW167.13 g/mol
LogP1.17
Rot. Bonds2

About N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide

N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide (PubChem CID 141350813) has the molecular formula C6H8F3NO and a molecular weight of 167.13 g/mol. Its IUPAC name is N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide.

Molecular Properties

Compound NameN-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide
PubChem CID141350813
Molecular FormulaC6H8F3NO
Molecular Weight167.13 g/mol
Exact Mass167.06
IUPAC NameN-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide
SMILESCN(C=O)C1(C(F)(F)F)CC1
InChIInChI=1S/C6H8F3NO/c1-10(4-11)5(2-3-5)6(7,8)9/h4H,2-3H2,1H3
InChIKeyRKYDQCFXXXVLIV-UHFFFAOYSA-N
XLogP1.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.13
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide?
The IUPAC name of N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide (CID 141350813) is N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide.
What is the SMILES notation for N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide?
The canonical SMILES for N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide is CN(C=O)C1(C(F)(F)F)CC1.
What is the InChIKey of N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide?
The InChIKey is RKYDQCFXXXVLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F3NO/c1-10(4-11)5(2-3-5)6(7,8)9/h4H,2-3H2,1H3.
What are the key properties of N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide?
N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide has a molecular weight of 167.13 g/mol, XLogP of 1.17, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(trifluoromethyl)cyclopropyl]formamide is sourced from PubChem (CID 141350813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).