CID 5462981

C6H14N — CID 5462981

IUPAC—
SMILESCC(C)[N]C(C)C
InChIInChI=1S/C6H14N/c1-5(2)7-6(3)4/h5-6H,1-4H3
InChIKeyNWMDMRWOXWXQEY-UHFFFAOYSA-N
MW100.18 g/mol
LogP1.41
Rot. Bonds2

About CID 5462981

CID 5462981 (PubChem CID 5462981) has the molecular formula C6H14N and a molecular weight of 100.18 g/mol.

Molecular Properties

Compound NameCID 5462981
PubChem CID5462981
Molecular FormulaC6H14N
Molecular Weight100.18 g/mol
Exact Mass100.11
IUPAC Name—
SMILESCC(C)[N]C(C)C
InChIInChI=1S/C6H14N/c1-5(2)7-6(3)4/h5-6H,1-4H3
InChIKeyNWMDMRWOXWXQEY-UHFFFAOYSA-N
XLogP1.41
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.18
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 171375193

Frequently Asked Questions

What is the IUPAC name of CID 5462981?
The IUPAC name of CID 5462981 (CID 5462981) is not available.
What is the SMILES notation for CID 5462981?
The canonical SMILES for CID 5462981 is CC(C)[N]C(C)C.
What is the InChIKey of CID 5462981?
The InChIKey is NWMDMRWOXWXQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N/c1-5(2)7-6(3)4/h5-6H,1-4H3.
What are the key properties of CID 5462981?
CID 5462981 has a molecular weight of 100.18 g/mol, XLogP of 1.41, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 5462981 is sourced from PubChem (CID 5462981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).