CID 59923851

C6H12N3 — CID 59923851

IUPAC—
SMILESC=C1N(C)[CH]N(C)N1C
InChIInChI=1S/C6H12N3/c1-6-7(2)5-8(3)9(6)4/h5H,1H2,2-4H3
InChIKeyPFAHACCALPCLKV-UHFFFAOYSA-N
MW126.18 g/mol
LogP0.30
Rot. Bonds

About CID 59923851

CID 59923851 (PubChem CID 59923851) has the molecular formula C6H12N3 and a molecular weight of 126.18 g/mol.

Molecular Properties

Compound NameCID 59923851
PubChem CID59923851
Molecular FormulaC6H12N3
Molecular Weight126.18 g/mol
Exact Mass126.10
IUPAC Name—
SMILESC=C1N(C)[CH]N(C)N1C
InChIInChI=1S/C6H12N3/c1-6-7(2)5-8(3)9(6)4/h5H,1H2,2-4H3
InChIKeyPFAHACCALPCLKV-UHFFFAOYSA-N
XLogP0.30
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.18
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59923851?
The IUPAC name of CID 59923851 (CID 59923851) is not available.
What is the SMILES notation for CID 59923851?
The canonical SMILES for CID 59923851 is C=C1N(C)[CH]N(C)N1C.
What is the InChIKey of CID 59923851?
The InChIKey is PFAHACCALPCLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N3/c1-6-7(2)5-8(3)9(6)4/h5H,1H2,2-4H3.
What are the key properties of CID 59923851?
CID 59923851 has a molecular weight of 126.18 g/mol, XLogP of 0.30, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59923851 is sourced from PubChem (CID 59923851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).