CID 57466056

C4H6N — CID 57466056

IUPAC—
SMILES[CH]1C=NCC1
InChIInChI=1S/C4H6N/c1-2-4-5-3-1/h1,3H,2,4H2
InChIKeyMUKXJDPQWWJDSX-UHFFFAOYSA-N
MW68.10 g/mol
LogP0.67
Rot. Bonds

About CID 57466056

CID 57466056 (PubChem CID 57466056) has the molecular formula C4H6N and a molecular weight of 68.10 g/mol.

Molecular Properties

Compound NameCID 57466056
PubChem CID57466056
Molecular FormulaC4H6N
Molecular Weight68.10 g/mol
Exact Mass68.05
IUPAC Name—
SMILES[CH]1C=NCC1
InChIInChI=1S/C4H6N/c1-2-4-5-3-1/h1,3H,2,4H2
InChIKeyMUKXJDPQWWJDSX-UHFFFAOYSA-N
XLogP0.67
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50068.10
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 57466056?
The IUPAC name of CID 57466056 (CID 57466056) is not available.
What is the SMILES notation for CID 57466056?
The canonical SMILES for CID 57466056 is [CH]1C=NCC1.
What is the InChIKey of CID 57466056?
The InChIKey is MUKXJDPQWWJDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N/c1-2-4-5-3-1/h1,3H,2,4H2.
What are the key properties of CID 57466056?
CID 57466056 has a molecular weight of 68.10 g/mol, XLogP of 0.67, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57466056 is sourced from PubChem (CID 57466056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).