CID 23244031

C19H25NO3 — CID 23244031

IUPAC—
SMILESc1ccc([C@H]2CN3O[C@@H]2CC32COC3(CCCCC3)OC2)cc1
InChIInChI=1S/C19H25NO3/c1-3-7-15(8-4-1)16-12-20-18(11-17(16)23-20)13-21-19(22-14-18)9-5-2-6-10-19/h1,3-4,7-8,16-17H,2,5-6,9-14H2/t16-,17-/m1/s1
InChIKeySMEPMKYKGSONEH-IAGOWNOFSA-N
MW315.41 g/mol
LogP3.24
Rot. Bonds1

About CID 23244031

CID 23244031 (PubChem CID 23244031) has the molecular formula C19H25NO3 and a molecular weight of 315.41 g/mol.

Molecular Properties

Compound NameCID 23244031
PubChem CID23244031
Molecular FormulaC19H25NO3
Molecular Weight315.41 g/mol
Exact Mass315.18
IUPAC Name—
SMILESc1ccc([C@H]2CN3O[C@@H]2CC32COC3(CCCCC3)OC2)cc1
InChIInChI=1S/C19H25NO3/c1-3-7-15(8-4-1)16-12-20-18(11-17(16)23-20)13-21-19(22-14-18)9-5-2-6-10-19/h1,3-4,7-8,16-17H,2,5-6,9-14H2/t16-,17-/m1/s1
InChIKeySMEPMKYKGSONEH-IAGOWNOFSA-N
XLogP3.24
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 23244031?
The IUPAC name of CID 23244031 (CID 23244031) is not available.
What is the SMILES notation for CID 23244031?
The canonical SMILES for CID 23244031 is c1ccc([C@H]2CN3O[C@@H]2CC32COC3(CCCCC3)OC2)cc1.
What is the InChIKey of CID 23244031?
The InChIKey is SMEPMKYKGSONEH-IAGOWNOFSA-N. The full InChI is InChI=1S/C19H25NO3/c1-3-7-15(8-4-1)16-12-20-18(11-17(16)23-20)13-21-19(22-14-18)9-5-2-6-10-19/h1,3-4,7-8,16-17H,2,5-6,9-14H2/t16-,17-/m1/s1.
What are the key properties of CID 23244031?
CID 23244031 has a molecular weight of 315.41 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23244031 is sourced from PubChem (CID 23244031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).