CID 173085999

C9H23AlN — CID 173085999

IUPAC—
SMILESCCN1CCCCC1.C[Al]C.[H][H]
InChIInChI=1S/C7H15N.2CH3.Al.H2/c1-2-8-6-4-3-5-7-8;;;;/h2-7H2,1H3;2*1H3;;1H
InChIKeyGHPTYPVJZLZZJF-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.53
Rot. Bonds1

About CID 173085999

CID 173085999 (PubChem CID 173085999) has the molecular formula C9H23AlN and a molecular weight of 172.27 g/mol.

Molecular Properties

Compound NameCID 173085999
PubChem CID173085999
Molecular FormulaC9H23AlN
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name—
SMILESCCN1CCCCC1.C[Al]C.[H][H]
InChIInChI=1S/C7H15N.2CH3.Al.H2/c1-2-8-6-4-3-5-7-8;;;;/h2-7H2,1H3;2*1H3;;1H
InChIKeyGHPTYPVJZLZZJF-UHFFFAOYSA-N
XLogP2.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 173085999?
The IUPAC name of CID 173085999 (CID 173085999) is not available.
What is the SMILES notation for CID 173085999?
The canonical SMILES for CID 173085999 is CCN1CCCCC1.C[Al]C.[H][H].
What is the InChIKey of CID 173085999?
The InChIKey is GHPTYPVJZLZZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.2CH3.Al.H2/c1-2-8-6-4-3-5-7-8;;;;/h2-7H2,1H3;2*1H3;;1H.
What are the key properties of CID 173085999?
CID 173085999 has a molecular weight of 172.27 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173085999 is sourced from PubChem (CID 173085999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).