CID 134964671

C10H18NO2 — CID 134964671

IUPAC—
SMILESC[C](CO)CC/C=C/C(=O)N(C)C
InChIInChI=1S/C10H18NO2/c1-9(8-12)6-4-5-7-10(13)11(2)3/h5,7,12H,4,6,8H2,1-3H3/b7-5+
InChIKeyHKAZOQFCBMMWQT-FNORWQNLSA-N
MW184.26 g/mol
LogP1.00
Rot. Bonds5

About CID 134964671

CID 134964671 (PubChem CID 134964671) has the molecular formula C10H18NO2 and a molecular weight of 184.26 g/mol.

Molecular Properties

Compound NameCID 134964671
PubChem CID134964671
Molecular FormulaC10H18NO2
Molecular Weight184.26 g/mol
Exact Mass184.13
IUPAC Name—
SMILESC[C](CO)CC/C=C/C(=O)N(C)C
InChIInChI=1S/C10H18NO2/c1-9(8-12)6-4-5-7-10(13)11(2)3/h5,7,12H,4,6,8H2,1-3H3/b7-5+
InChIKeyHKAZOQFCBMMWQT-FNORWQNLSA-N
XLogP1.00
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 134964671?
The IUPAC name of CID 134964671 (CID 134964671) is not available.
What is the SMILES notation for CID 134964671?
The canonical SMILES for CID 134964671 is C[C](CO)CC/C=C/C(=O)N(C)C.
What is the InChIKey of CID 134964671?
The InChIKey is HKAZOQFCBMMWQT-FNORWQNLSA-N. The full InChI is InChI=1S/C10H18NO2/c1-9(8-12)6-4-5-7-10(13)11(2)3/h5,7,12H,4,6,8H2,1-3H3/b7-5+.
What are the key properties of CID 134964671?
CID 134964671 has a molecular weight of 184.26 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134964671 is sourced from PubChem (CID 134964671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).