CID 58998116

C8H15N — CID 58998116

IUPAC—
SMILES[CH]C(C)(C)N1CCCC1
InChIInChI=1S/C8H15N/c1-8(2,3)9-6-4-5-7-9/h1H,4-7H2,2-3H3
InChIKeyDPSJAWISHNDOFL-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.57
Rot. Bonds1

About CID 58998116

CID 58998116 (PubChem CID 58998116) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol.

Molecular Properties

Compound NameCID 58998116
PubChem CID58998116
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name—
SMILES[CH]C(C)(C)N1CCCC1
InChIInChI=1S/C8H15N/c1-8(2,3)9-6-4-5-7-9/h1H,4-7H2,2-3H3
InChIKeyDPSJAWISHNDOFL-UHFFFAOYSA-N
XLogP1.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.57
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 58998116?
The IUPAC name of CID 58998116 (CID 58998116) is not available.
What is the SMILES notation for CID 58998116?
The canonical SMILES for CID 58998116 is [CH]C(C)(C)N1CCCC1.
What is the InChIKey of CID 58998116?
The InChIKey is DPSJAWISHNDOFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-8(2,3)9-6-4-5-7-9/h1H,4-7H2,2-3H3.
What are the key properties of CID 58998116?
CID 58998116 has a molecular weight of 125.21 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58998116 is sourced from PubChem (CID 58998116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).