1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine

C10H19F2N — CID 170222804

IUPAC1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine
SMILESCC(C)CC1(CN(C)C)CC1(F)F
InChIInChI=1S/C10H19F2N/c1-8(2)5-9(7-13(3)4)6-10(9,11)12/h8H,5-7H2,1-4H3
InChIKeyFDICVEZFHPCUOC-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.62
Rot. Bonds4

About 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine

1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine (PubChem CID 170222804) has the molecular formula C10H19F2N and a molecular weight of 191.26 g/mol. Its IUPAC name is 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine
PubChem CID170222804
Molecular FormulaC10H19F2N
Molecular Weight191.26 g/mol
Exact Mass191.15
IUPAC Name1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine
SMILESCC(C)CC1(CN(C)C)CC1(F)F
InChIInChI=1S/C10H19F2N/c1-8(2)5-9(7-13(3)4)6-10(9,11)12/h8H,5-7H2,1-4H3
InChIKeyFDICVEZFHPCUOC-UHFFFAOYSA-N
XLogP2.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine (CID 170222804) is 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine is CC(C)CC1(CN(C)C)CC1(F)F.
What is the InChIKey of 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine?
The InChIKey is FDICVEZFHPCUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F2N/c1-8(2)5-9(7-13(3)4)6-10(9,11)12/h8H,5-7H2,1-4H3.
What are the key properties of 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine?
1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine has a molecular weight of 191.26 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,2-difluoro-1-(2-methylpropyl)cyclopropyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 170222804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).