CID 177364126

C15H26NO — CID 177364126

IUPAC—
SMILESCC(C)(C)C.O=C(CN1CCCCC1)C1=C[CH]1
InChIInChI=1S/C10H14NO.C5H12/c12-10(9-4-5-9)8-11-6-2-1-3-7-11;1-5(2,3)4/h4-5H,1-3,6-8H2;1-4H3
InChIKeyHVVCIOQADFIDPS-UHFFFAOYSA-N
MW236.38 g/mol
LogP3.24
Rot. Bonds3

About CID 177364126

CID 177364126 (PubChem CID 177364126) has the molecular formula C15H26NO and a molecular weight of 236.38 g/mol.

Molecular Properties

Compound NameCID 177364126
PubChem CID177364126
Molecular FormulaC15H26NO
Molecular Weight236.38 g/mol
Exact Mass236.20
IUPAC Name—
SMILESCC(C)(C)C.O=C(CN1CCCCC1)C1=C[CH]1
InChIInChI=1S/C10H14NO.C5H12/c12-10(9-4-5-9)8-11-6-2-1-3-7-11;1-5(2,3)4/h4-5H,1-3,6-8H2;1-4H3
InChIKeyHVVCIOQADFIDPS-UHFFFAOYSA-N
XLogP3.24
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 177364126?
The IUPAC name of CID 177364126 (CID 177364126) is not available.
What is the SMILES notation for CID 177364126?
The canonical SMILES for CID 177364126 is CC(C)(C)C.O=C(CN1CCCCC1)C1=C[CH]1.
What is the InChIKey of CID 177364126?
The InChIKey is HVVCIOQADFIDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14NO.C5H12/c12-10(9-4-5-9)8-11-6-2-1-3-7-11;1-5(2,3)4/h4-5H,1-3,6-8H2;1-4H3.
What are the key properties of CID 177364126?
CID 177364126 has a molecular weight of 236.38 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177364126 is sourced from PubChem (CID 177364126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).