CID 59895910

C5H7N3 — CID 59895910

IUPAC—
SMILES[CH]c1nnc(C)n1C
InChIInChI=1S/C5H7N3/c1-4-6-7-5(2)8(4)3/h1H,2-3H3
InChIKeyDIKXHLHSIPCYHU-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.18
Rot. Bonds

About CID 59895910

CID 59895910 (PubChem CID 59895910) has the molecular formula C5H7N3 and a molecular weight of 109.13 g/mol.

Molecular Properties

Compound NameCID 59895910
PubChem CID59895910
Molecular FormulaC5H7N3
Molecular Weight109.13 g/mol
Exact Mass109.06
IUPAC Name—
SMILES[CH]c1nnc(C)n1C
InChIInChI=1S/C5H7N3/c1-4-6-7-5(2)8(4)3/h1H,2-3H3
InChIKeyDIKXHLHSIPCYHU-UHFFFAOYSA-N
XLogP0.18
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59895910?
The IUPAC name of CID 59895910 (CID 59895910) is not available.
What is the SMILES notation for CID 59895910?
The canonical SMILES for CID 59895910 is [CH]c1nnc(C)n1C.
What is the InChIKey of CID 59895910?
The InChIKey is DIKXHLHSIPCYHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3/c1-4-6-7-5(2)8(4)3/h1H,2-3H3.
What are the key properties of CID 59895910?
CID 59895910 has a molecular weight of 109.13 g/mol, XLogP of 0.18, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59895910 is sourced from PubChem (CID 59895910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).