[1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine

C12H21F3N2O — CID 103217647

IUPAC[1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
SMILESNNC(COCC(F)(F)F)CC1CC2CCC1C2
InChIInChI=1S/C12H21F3N2O/c13-12(14,15)7-18-6-11(17-16)5-10-4-8-1-2-9(10)3-8/h8-11,17H,1-7,16H2
InChIKeyNUAIMMCKECIWLP-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.22
Rot. Bonds6

About [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine

[1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine (PubChem CID 103217647) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
PubChem CID103217647
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC Name[1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine
SMILESNNC(COCC(F)(F)F)CC1CC2CCC1C2
InChIInChI=1S/C12H21F3N2O/c13-12(14,15)7-18-6-11(17-16)5-10-4-8-1-2-9(10)3-8/h8-11,17H,1-7,16H2
InChIKeyNUAIMMCKECIWLP-UHFFFAOYSA-N
XLogP2.22
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

CID 103148206
CID 103148206
CID 103149113
CID 103149113
CID 103151759
CID 103151759
CID 103215842
CID 103215842
CID 103217515
CID 103217515
CID 103217539
CID 103217539
CID 103217541
CID 103217541
CID 103217552
CID 103217552
CID 103217553
CID 103217553
CID 103475108
CID 103475108
CID 103477677
CID 103477677
CID 103477747
CID 103477747

Frequently Asked Questions

What is the IUPAC name of [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
The IUPAC name of [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine (CID 103217647) is [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine is NNC(COCC(F)(F)F)CC1CC2CCC1C2.
What is the InChIKey of [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
The InChIKey is NUAIMMCKECIWLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c13-12(14,15)7-18-6-11(17-16)5-10-4-8-1-2-9(10)3-8/h8-11,17H,1-7,16H2.
What are the key properties of [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine?
[1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine has a molecular weight of 266.31 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bicyclo[2.2.1]heptanyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]hydrazine is sourced from PubChem (CID 103217647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).