CID 59923853

C5H12N3 — CID 59923853

IUPAC—
SMILESCC1NN(C)[CH]N1C
InChIInChI=1S/C5H12N3/c1-5-6-8(3)4-7(5)2/h4-6H,1-3H3
InChIKeyJJVUSFRDMFYNKM-UHFFFAOYSA-N
MW114.17 g/mol
LogP-0.17
Rot. Bonds

About CID 59923853

CID 59923853 (PubChem CID 59923853) has the molecular formula C5H12N3 and a molecular weight of 114.17 g/mol.

Molecular Properties

Compound NameCID 59923853
PubChem CID59923853
Molecular FormulaC5H12N3
Molecular Weight114.17 g/mol
Exact Mass114.10
IUPAC Name—
SMILESCC1NN(C)[CH]N1C
InChIInChI=1S/C5H12N3/c1-5-6-8(3)4-7(5)2/h4-6H,1-3H3
InChIKeyJJVUSFRDMFYNKM-UHFFFAOYSA-N
XLogP-0.17
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.17
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59923853?
The IUPAC name of CID 59923853 (CID 59923853) is not available.
What is the SMILES notation for CID 59923853?
The canonical SMILES for CID 59923853 is CC1NN(C)[CH]N1C.
What is the InChIKey of CID 59923853?
The InChIKey is JJVUSFRDMFYNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N3/c1-5-6-8(3)4-7(5)2/h4-6H,1-3H3.
What are the key properties of CID 59923853?
CID 59923853 has a molecular weight of 114.17 g/mol, XLogP of -0.17, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59923853 is sourced from PubChem (CID 59923853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).