CID 59407136

C5H8N2 — CID 59407136

IUPAC—
SMILES[CH]CC1=NCCN1
InChIInChI=1S/C5H8N2/c1-2-5-6-3-4-7-5/h1H,2-4H2,(H,6,7)
InChIKeyZBTZYAWNSWUOFW-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.09
Rot. Bonds1

About CID 59407136

CID 59407136 (PubChem CID 59407136) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol.

Molecular Properties

Compound NameCID 59407136
PubChem CID59407136
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name—
SMILES[CH]CC1=NCCN1
InChIInChI=1S/C5H8N2/c1-2-5-6-3-4-7-5/h1H,2-4H2,(H,6,7)
InChIKeyZBTZYAWNSWUOFW-UHFFFAOYSA-N
XLogP0.09
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methylimidazoline
CID 10798
2-Imidazoline, 2-ethyl-
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2-Imidazoline, 2-propyl-
CID 27291
2-Butyl-2-imidazoline
CID 25284
1H-Imidazole, 2-ethyl-4,5-dihydro-5-methyl-
CID 13604
1H-Imidazole, 4,5-dihydro-2,5-dimethyl-
CID 102522
1,4-Diazepan-5-imine
CID 18721714
(4,5-dihydro-1H-imidazol-2-yl)methanamine dihydrochloride
CID 12621845
2-Isobutyl-2-imidazoline
CID 12587213
2-(5-Methyl-2-imidazolin-2-yl) propane
CID 21191557
2-Isopropyl-4,5-dihydro-1H-imidazole
CID 535189
1,2-Bis(4,5-dihydro-1h-imidazol-2-yl)ethane
CID 12535969

Frequently Asked Questions

What is the IUPAC name of CID 59407136?
The IUPAC name of CID 59407136 (CID 59407136) is not available.
What is the SMILES notation for CID 59407136?
The canonical SMILES for CID 59407136 is [CH]CC1=NCCN1.
What is the InChIKey of CID 59407136?
The InChIKey is ZBTZYAWNSWUOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-2-5-6-3-4-7-5/h1H,2-4H2,(H,6,7).
What are the key properties of CID 59407136?
CID 59407136 has a molecular weight of 96.13 g/mol, XLogP of 0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59407136 is sourced from PubChem (CID 59407136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).