carbamic acid;2-fluoropyrimidine

C5H6FN3O2 — CID 66643482

IUPACcarbamic acid;2-fluoropyrimidine
SMILESFc1ncccn1.NC(=O)O
InChIInChI=1S/C4H3FN2.CH3NO2/c5-4-6-2-1-3-7-4;2-1(3)4/h1-3H;2H2,(H,3,4)
InChIKeyBZRPOJFQTMPGJK-UHFFFAOYSA-N
MW159.12 g/mol
LogP0.24
Rot. Bonds

About carbamic acid;2-fluoropyrimidine

carbamic acid;2-fluoropyrimidine (PubChem CID 66643482) has the molecular formula C5H6FN3O2 and a molecular weight of 159.12 g/mol. Its IUPAC name is carbamic acid;2-fluoropyrimidine.

Molecular Properties

Compound Namecarbamic acid;2-fluoropyrimidine
PubChem CID66643482
Molecular FormulaC5H6FN3O2
Molecular Weight159.12 g/mol
Exact Mass159.04
IUPAC Namecarbamic acid;2-fluoropyrimidine
SMILESFc1ncccn1.NC(=O)O
InChIInChI=1S/C4H3FN2.CH3NO2/c5-4-6-2-1-3-7-4;2-1(3)4/h1-3H;2H2,(H,3,4)
InChIKeyBZRPOJFQTMPGJK-UHFFFAOYSA-N
XLogP0.24
TPSA89.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.12
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of carbamic acid;2-fluoropyrimidine?
The IUPAC name of carbamic acid;2-fluoropyrimidine (CID 66643482) is carbamic acid;2-fluoropyrimidine.
What is the SMILES notation for carbamic acid;2-fluoropyrimidine?
The canonical SMILES for carbamic acid;2-fluoropyrimidine is Fc1ncccn1.NC(=O)O.
What is the InChIKey of carbamic acid;2-fluoropyrimidine?
The InChIKey is BZRPOJFQTMPGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3FN2.CH3NO2/c5-4-6-2-1-3-7-4;2-1(3)4/h1-3H;2H2,(H,3,4).
What are the key properties of carbamic acid;2-fluoropyrimidine?
carbamic acid;2-fluoropyrimidine has a molecular weight of 159.12 g/mol, XLogP of 0.24, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;2-fluoropyrimidine is sourced from PubChem (CID 66643482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).