CID 59919920

C13H25N2O2 — CID 59919920

IUPAC—
SMILESCCC1(C)CC(=O)N(C)C(C)C(C)(CC)N1[O]
InChIInChI=1S/C13H25N2O2/c1-7-12(4)9-11(16)14(6)10(3)13(5,8-2)15(12)17/h10H,7-9H2,1-6H3
InChIKeyHLJDZMFXESOIQI-UHFFFAOYSA-N
MW241.35 g/mol
LogP2.22
Rot. Bonds2

About CID 59919920

CID 59919920 (PubChem CID 59919920) has the molecular formula C13H25N2O2 and a molecular weight of 241.35 g/mol.

Molecular Properties

Compound NameCID 59919920
PubChem CID59919920
Molecular FormulaC13H25N2O2
Molecular Weight241.35 g/mol
Exact Mass241.19
IUPAC Name—
SMILESCCC1(C)CC(=O)N(C)C(C)C(C)(CC)N1[O]
InChIInChI=1S/C13H25N2O2/c1-7-12(4)9-11(16)14(6)10(3)13(5,8-2)15(12)17/h10H,7-9H2,1-6H3
InChIKeyHLJDZMFXESOIQI-UHFFFAOYSA-N
XLogP2.22
TPSA43.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.35
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,7-Diethyl-1-hydroxy-2,3,7-trimethyl-1,4-diazepan-5-one
CID 18760513
1-Butyl-3-ethyl-4-hydroxy-3,5,5,7-tetramethyl-1,4-diazepan-2-one
CID 18760550
2,7-Diethyl-1-hydroxy-2,3,4,7-tetramethyl-1,4-diazepan-5-one
CID 18760564
1,4-Dihydroxy-2,2,7,7-tetramethyl-1,4-diazepan-5-one
CID 20683173
CID 59360345
CID 59360345
CID 59919907
CID 59919907
CID 59919926
CID 59919926
CID 59919929
CID 59919929
CID 59919931
CID 59919931
CID 59967311
CID 59967311
1-Hydroxy-2,2,4,7,7-pentamethyl-1,4-diazepan-5-one
CID 71106000
2,2,7,7-Tetraethyl-1-hydroxy-1,4-diazepan-5-one
CID 91988600

Frequently Asked Questions

What is the IUPAC name of CID 59919920?
The IUPAC name of CID 59919920 (CID 59919920) is not available.
What is the SMILES notation for CID 59919920?
The canonical SMILES for CID 59919920 is CCC1(C)CC(=O)N(C)C(C)C(C)(CC)N1[O].
What is the InChIKey of CID 59919920?
The InChIKey is HLJDZMFXESOIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N2O2/c1-7-12(4)9-11(16)14(6)10(3)13(5,8-2)15(12)17/h10H,7-9H2,1-6H3.
What are the key properties of CID 59919920?
CID 59919920 has a molecular weight of 241.35 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59919920 is sourced from PubChem (CID 59919920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).