CID 59694733

C7H14NO — CID 59694733

IUPAC—
SMILESCC[C@H](C)[C@H]1CO[CH]N1
InChIInChI=1S/C7H14NO/c1-3-6(2)7-4-9-5-8-7/h5-8H,3-4H2,1-2H3/t6-,7+/m0/s1
InChIKeyFXULOSSSJVYZGI-NKWVEPMBSA-N
MW128.19 g/mol
LogP1.14
Rot. Bonds2

About CID 59694733

CID 59694733 (PubChem CID 59694733) has the molecular formula C7H14NO and a molecular weight of 128.19 g/mol.

Molecular Properties

Compound NameCID 59694733
PubChem CID59694733
Molecular FormulaC7H14NO
Molecular Weight128.19 g/mol
Exact Mass128.11
IUPAC Name—
SMILESCC[C@H](C)[C@H]1CO[CH]N1
InChIInChI=1S/C7H14NO/c1-3-6(2)7-4-9-5-8-7/h5-8H,3-4H2,1-2H3/t6-,7+/m0/s1
InChIKeyFXULOSSSJVYZGI-NKWVEPMBSA-N
XLogP1.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.19
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59694733?
The IUPAC name of CID 59694733 (CID 59694733) is not available.
What is the SMILES notation for CID 59694733?
The canonical SMILES for CID 59694733 is CC[C@H](C)[C@H]1CO[CH]N1.
What is the InChIKey of CID 59694733?
The InChIKey is FXULOSSSJVYZGI-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H14NO/c1-3-6(2)7-4-9-5-8-7/h5-8H,3-4H2,1-2H3/t6-,7+/m0/s1.
What are the key properties of CID 59694733?
CID 59694733 has a molecular weight of 128.19 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59694733 is sourced from PubChem (CID 59694733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).