CID 58998211

C7H15N — CID 58998211

IUPAC—
SMILES[CH]CCN(CC)CC
InChIInChI=1S/C7H15N/c1-4-7-8(5-2)6-3/h1H,4-7H2,2-3H3
InChIKeyFKWBEKQGOJHQNM-UHFFFAOYSA-N
MW113.20 g/mol
LogP1.43
Rot. Bonds4

About CID 58998211

CID 58998211 (PubChem CID 58998211) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol.

Molecular Properties

Compound NameCID 58998211
PubChem CID58998211
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name—
SMILES[CH]CCN(CC)CC
InChIInChI=1S/C7H15N/c1-4-7-8(5-2)6-3/h1H,4-7H2,2-3H3
InChIKeyFKWBEKQGOJHQNM-UHFFFAOYSA-N
XLogP1.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 58998211?
The IUPAC name of CID 58998211 (CID 58998211) is not available.
What is the SMILES notation for CID 58998211?
The canonical SMILES for CID 58998211 is [CH]CCN(CC)CC.
What is the InChIKey of CID 58998211?
The InChIKey is FKWBEKQGOJHQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N/c1-4-7-8(5-2)6-3/h1H,4-7H2,2-3H3.
What are the key properties of CID 58998211?
CID 58998211 has a molecular weight of 113.20 g/mol, XLogP of 1.43, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58998211 is sourced from PubChem (CID 58998211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).