1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine

C11H16F2N2 — CID 80604591

IUPAC1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine
SMILESCCCNC(C)(c1ccccn1)C(F)F
InChIInChI=1S/C11H16F2N2/c1-3-7-15-11(2,10(12)13)9-6-4-5-8-14-9/h4-6,8,10,15H,3,7H2,1-2H3
InChIKeyVFESXXGKIUOHNR-UHFFFAOYSA-N
MW214.26 g/mol
LogP2.56
Rot. Bonds5

About 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine

1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine (PubChem CID 80604591) has the molecular formula C11H16F2N2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine.

Molecular Properties

Compound Name1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine
PubChem CID80604591
Molecular FormulaC11H16F2N2
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine
SMILESCCCNC(C)(c1ccccn1)C(F)F
InChIInChI=1S/C11H16F2N2/c1-3-7-15-11(2,10(12)13)9-6-4-5-8-14-9/h4-6,8,10,15H,3,7H2,1-2H3
InChIKeyVFESXXGKIUOHNR-UHFFFAOYSA-N
XLogP2.56
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1,1-difluoro-2-pyridin-2-ylpropan-2-amine
CID 80605991
2-(2-ethoxyphenyl)-1,1-difluoro-N-propylpropan-2-amine
CID 80604708
2-(1,1-difluoro-2-methylpropyl)pyridine
CID 116841481
2-(2-ethoxybutan-2-yl)pyridine
CID 146396878
2-(1,1-difluoropropyl)pyridine
CID 59088790
1,1,3,3-tetrafluoro-2-pyridin-2-ylpropan-2-ol
CID 153440698
2,2-dimethyl-N-propyl-1-pyridin-2-ylpropan-1-amine
CID 62395548
2-(2-ethoxy-4-methylpentan-2-yl)pyridine
CID 146397028
2-(2-pyridin-2-ylpropan-2-yloxy)ethanol
CID 141291865
2,2-difluoro-N-propyl-4-pyridin-2-ylpentan-3-amine
CID 114249556
2-tert-butylpyridine;ethane;methane
CID 143332153
2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol
CID 61049210

Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine?
The IUPAC name of 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine (CID 80604591) is 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine.
What is the SMILES notation for 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine?
The canonical SMILES for 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine is CCCNC(C)(c1ccccn1)C(F)F.
What is the InChIKey of 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine?
The InChIKey is VFESXXGKIUOHNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2N2/c1-3-7-15-11(2,10(12)13)9-6-4-5-8-14-9/h4-6,8,10,15H,3,7H2,1-2H3.
What are the key properties of 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine?
1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine has a molecular weight of 214.26 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-N-propyl-2-pyridin-2-ylpropan-2-amine is sourced from PubChem (CID 80604591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).