CID 139244194

C5H7N — CID 139244194

IUPAC—
SMILESC=C1[C]NCC1
InChIInChI=1S/C5H7N/c1-5-2-3-6-4-5/h6H,1-3H2
InChIKeyCZNUANRFITYEGW-UHFFFAOYSA-N
MW81.12 g/mol
LogP0.57
Rot. Bonds

About CID 139244194

CID 139244194 (PubChem CID 139244194) has the molecular formula C5H7N and a molecular weight of 81.12 g/mol.

Molecular Properties

Compound NameCID 139244194
PubChem CID139244194
Molecular FormulaC5H7N
Molecular Weight81.12 g/mol
Exact Mass81.06
IUPAC Name—
SMILESC=C1[C]NCC1
InChIInChI=1S/C5H7N/c1-5-2-3-6-4-5/h6H,1-3H2
InChIKeyCZNUANRFITYEGW-UHFFFAOYSA-N
XLogP0.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50081.12
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 139244194?
The IUPAC name of CID 139244194 (CID 139244194) is not available.
What is the SMILES notation for CID 139244194?
The canonical SMILES for CID 139244194 is C=C1[C]NCC1.
What is the InChIKey of CID 139244194?
The InChIKey is CZNUANRFITYEGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N/c1-5-2-3-6-4-5/h6H,1-3H2.
What are the key properties of CID 139244194?
CID 139244194 has a molecular weight of 81.12 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139244194 is sourced from PubChem (CID 139244194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).