CID 59901972

C6H11N — CID 59901972

IUPAC—
SMILES[CH]=C([CH]C)N(C)C
InChIInChI=1S/C6H11N/c1-5-6(2)7(3)4/h2,5H,1,3-4H3
InChIKeyTXVVTTIBIQMWQM-UHFFFAOYSA-N
MW97.16 g/mol
LogP1.09
Rot. Bonds2

About CID 59901972

CID 59901972 (PubChem CID 59901972) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol.

Molecular Properties

Compound NameCID 59901972
PubChem CID59901972
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Name—
SMILES[CH]=C([CH]C)N(C)C
InChIInChI=1S/C6H11N/c1-5-6(2)7(3)4/h2,5H,1,3-4H3
InChIKeyTXVVTTIBIQMWQM-UHFFFAOYSA-N
XLogP1.09
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 59901972?
The IUPAC name of CID 59901972 (CID 59901972) is not available.
What is the SMILES notation for CID 59901972?
The canonical SMILES for CID 59901972 is [CH]=C([CH]C)N(C)C.
What is the InChIKey of CID 59901972?
The InChIKey is TXVVTTIBIQMWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c1-5-6(2)7(3)4/h2,5H,1,3-4H3.
What are the key properties of CID 59901972?
CID 59901972 has a molecular weight of 97.16 g/mol, XLogP of 1.09, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59901972 is sourced from PubChem (CID 59901972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).