CID 59270461

C5H11NO — CID 59270461

IUPAC—
SMILES[CH]CN(C)CCO
InChIInChI=1S/C5H11NO/c1-3-6(2)4-5-7/h1,7H,3-5H2,2H3
InChIKeyIUWCINDUTGGRAS-UHFFFAOYSA-N
MW101.15 g/mol
LogP-0.38
Rot. Bonds3

About CID 59270461

CID 59270461 (PubChem CID 59270461) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol.

Molecular Properties

Compound NameCID 59270461
PubChem CID59270461
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name—
SMILES[CH]CN(C)CCO
InChIInChI=1S/C5H11NO/c1-3-6(2)4-5-7/h1,7H,3-5H2,2H3
InChIKeyIUWCINDUTGGRAS-UHFFFAOYSA-N
XLogP-0.38
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze CID 59270461 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 59270461?
The IUPAC name of CID 59270461 (CID 59270461) is not available.
What is the SMILES notation for CID 59270461?
The canonical SMILES for CID 59270461 is [CH]CN(C)CCO.
What is the InChIKey of CID 59270461?
The InChIKey is IUWCINDUTGGRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-3-6(2)4-5-7/h1,7H,3-5H2,2H3.
What are the key properties of CID 59270461?
CID 59270461 has a molecular weight of 101.15 g/mol, XLogP of -0.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59270461 is sourced from PubChem (CID 59270461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).