CID 172772830

C5H11KN — CID 172772830

IUPAC—
SMILESCN1CCCC1.[K]
InChIInChI=1S/C5H11N.K/c1-6-4-2-3-5-6;/h2-5H2,1H3;
InChIKeyNEQGEBISNZCNAM-UHFFFAOYSA-N
MW124.25 g/mol
LogP0.33
Rot. Bonds

About CID 172772830

CID 172772830 (PubChem CID 172772830) has the molecular formula C5H11KN and a molecular weight of 124.25 g/mol.

Molecular Properties

Compound NameCID 172772830
PubChem CID172772830
Molecular FormulaC5H11KN
Molecular Weight124.25 g/mol
Exact Mass124.05
IUPAC Name—
SMILESCN1CCCC1.[K]
InChIInChI=1S/C5H11N.K/c1-6-4-2-3-5-6;/h2-5H2,1H3;
InChIKeyNEQGEBISNZCNAM-UHFFFAOYSA-N
XLogP0.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.25
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 172772830?
The IUPAC name of CID 172772830 (CID 172772830) is not available.
What is the SMILES notation for CID 172772830?
The canonical SMILES for CID 172772830 is CN1CCCC1.[K].
What is the InChIKey of CID 172772830?
The InChIKey is NEQGEBISNZCNAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.K/c1-6-4-2-3-5-6;/h2-5H2,1H3;.
What are the key properties of CID 172772830?
CID 172772830 has a molecular weight of 124.25 g/mol, XLogP of 0.33, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172772830 is sourced from PubChem (CID 172772830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).