CID 58611583

C5H10N2 — CID 58611583

IUPAC—
SMILES[CH]N(C)N=C(C)C
InChIInChI=1S/C5H10N2/c1-5(2)6-7(3)4/h3H,1-2,4H3
InChIKeyBDFKLIPYJKQPEI-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.98
Rot. Bonds1

About CID 58611583

CID 58611583 (PubChem CID 58611583) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol.

Molecular Properties

Compound NameCID 58611583
PubChem CID58611583
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name—
SMILES[CH]N(C)N=C(C)C
InChIInChI=1S/C5H10N2/c1-5(2)6-7(3)4/h3H,1-2,4H3
InChIKeyBDFKLIPYJKQPEI-UHFFFAOYSA-N
XLogP0.98
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-(propan-2-ylideneamino)butan-1-amine
CID 143073582
(3Z)-3-(dimethylhydrazinylidene)butan-2-one
CID 93497612
disodium;(1Z,3Z)-N,N'-di(ethanethioyl)-N,N'-dimethylpropanedihydrazonate
CID 11529840
(1Z)-N,N-dimethylethanehydrazonoyl chloride
CID 88890719
CID 59957402
CID 59957402
N,N-dimethyl-1-(propan-2-ylideneamino)methanamine
CID 21338698
N'-[hydroxy(methyl)amino]ethanimidamide
CID 90334672
N-methyl-N-(propan-2-ylideneamino)-2H-tetrazol-5-amine
CID 90031759
N-(2-hydroxyethyl)-N-(propan-2-ylideneamino)acetamide
CID 130126252
N,N-dimethylethanethioamide;hydrazine
CID 159847458
methyl N-ethyl-N-(propan-2-ylideneamino)carbamodithioate
CID 59894433
methyl N-[methoxy(methyl)sulfamoyl]carbamate
CID 114463076

Frequently Asked Questions

What is the IUPAC name of CID 58611583?
The IUPAC name of CID 58611583 (CID 58611583) is not available.
What is the SMILES notation for CID 58611583?
The canonical SMILES for CID 58611583 is [CH]N(C)N=C(C)C.
What is the InChIKey of CID 58611583?
The InChIKey is BDFKLIPYJKQPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-5(2)6-7(3)4/h3H,1-2,4H3.
What are the key properties of CID 58611583?
CID 58611583 has a molecular weight of 98.15 g/mol, XLogP of 0.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58611583 is sourced from PubChem (CID 58611583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).