CID 5477031

C7H17N3 — CID 5477031

IUPAC—
SMILESCN(CCC[NH])CCC[NH]
InChIInChI=1S/C7H17N3/c1-10(6-2-4-8)7-3-5-9/h8-9H,2-7H2,1H3
InChIKeyUFDOJQILJNFDAC-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.26
Rot. Bonds6

About CID 5477031

CID 5477031 (PubChem CID 5477031) has the molecular formula C7H17N3 and a molecular weight of 143.23 g/mol.

Molecular Properties

Compound NameCID 5477031
PubChem CID5477031
Molecular FormulaC7H17N3
Molecular Weight143.23 g/mol
Exact Mass143.14
IUPAC Name—
SMILESCN(CCC[NH])CCC[NH]
InChIInChI=1S/C7H17N3/c1-10(6-2-4-8)7-3-5-9/h8-9H,2-7H2,1H3
InChIKeyUFDOJQILJNFDAC-UHFFFAOYSA-N
XLogP0.26
TPSA50.84 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 5477031?
The IUPAC name of CID 5477031 (CID 5477031) is not available.
What is the SMILES notation for CID 5477031?
The canonical SMILES for CID 5477031 is CN(CCC[NH])CCC[NH].
What is the InChIKey of CID 5477031?
The InChIKey is UFDOJQILJNFDAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3/c1-10(6-2-4-8)7-3-5-9/h8-9H,2-7H2,1H3.
What are the key properties of CID 5477031?
CID 5477031 has a molecular weight of 143.23 g/mol, XLogP of 0.26, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 5477031 is sourced from PubChem (CID 5477031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).