CID 59041170

C16H30NO2 — CID 59041170

IUPAC—
SMILESCC1C2(CCC(C)(C)O2)C(C)C(C)(C)N([O])C1(C)C
InChIInChI=1S/C16H30NO2/c1-11-14(5,6)17(18)15(7,8)12(2)16(11)10-9-13(3,4)19-16/h11-12H,9-10H2,1-8H3
InChIKeyROKARFVSJHRVDB-UHFFFAOYSA-N
MW268.42 g/mol
LogP3.80
Rot. Bonds

About CID 59041170

CID 59041170 (PubChem CID 59041170) has the molecular formula C16H30NO2 and a molecular weight of 268.42 g/mol.

Molecular Properties

Compound NameCID 59041170
PubChem CID59041170
Molecular FormulaC16H30NO2
Molecular Weight268.42 g/mol
Exact Mass268.23
IUPAC Name—
SMILESCC1C2(CCC(C)(C)O2)C(C)C(C)(C)N([O])C1(C)C
InChIInChI=1S/C16H30NO2/c1-11-14(5,6)17(18)15(7,8)12(2)16(11)10-9-13(3,4)19-16/h11-12H,9-10H2,1-8H3
InChIKeyROKARFVSJHRVDB-UHFFFAOYSA-N
XLogP3.80
TPSA32.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.42
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59041170?
The IUPAC name of CID 59041170 (CID 59041170) is not available.
What is the SMILES notation for CID 59041170?
The canonical SMILES for CID 59041170 is CC1C2(CCC(C)(C)O2)C(C)C(C)(C)N([O])C1(C)C.
What is the InChIKey of CID 59041170?
The InChIKey is ROKARFVSJHRVDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30NO2/c1-11-14(5,6)17(18)15(7,8)12(2)16(11)10-9-13(3,4)19-16/h11-12H,9-10H2,1-8H3.
What are the key properties of CID 59041170?
CID 59041170 has a molecular weight of 268.42 g/mol, XLogP of 3.80, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59041170 is sourced from PubChem (CID 59041170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).