CID 162563707

C19H25F2N3O3 — CID 162563707

IUPAC—
SMILESCOC1CCC2(CC1)Cc1ccc(OC(F)F)cc1C21NC(N)N(C)C1=O
InChIInChI=1S/C19H25F2N3O3/c1-24-15(25)19(23-17(24)22)14-9-13(27-16(20)21)4-3-11(14)10-18(19)7-5-12(26-2)6-8-18/h3-4,9,12,16-17,23H,5-8,10,22H2,1-2H3
InChIKeyNIPLHOJPNRCDIS-UHFFFAOYSA-N
MW381.42 g/mol
LogP1.92
Rot. Bonds3

About CID 162563707

CID 162563707 (PubChem CID 162563707) has the molecular formula C19H25F2N3O3 and a molecular weight of 381.42 g/mol.

Molecular Properties

Compound NameCID 162563707
PubChem CID162563707
Molecular FormulaC19H25F2N3O3
Molecular Weight381.42 g/mol
Exact Mass381.19
IUPAC Name—
SMILESCOC1CCC2(CC1)Cc1ccc(OC(F)F)cc1C21NC(N)N(C)C1=O
InChIInChI=1S/C19H25F2N3O3/c1-24-15(25)19(23-17(24)22)14-9-13(27-16(20)21)4-3-11(14)10-18(19)7-5-12(26-2)6-8-18/h3-4,9,12,16-17,23H,5-8,10,22H2,1-2H3
InChIKeyNIPLHOJPNRCDIS-UHFFFAOYSA-N
XLogP1.92
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.42
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of CID 162563707?
The IUPAC name of CID 162563707 (CID 162563707) is not available.
What is the SMILES notation for CID 162563707?
The canonical SMILES for CID 162563707 is COC1CCC2(CC1)Cc1ccc(OC(F)F)cc1C21NC(N)N(C)C1=O.
What is the InChIKey of CID 162563707?
The InChIKey is NIPLHOJPNRCDIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25F2N3O3/c1-24-15(25)19(23-17(24)22)14-9-13(27-16(20)21)4-3-11(14)10-18(19)7-5-12(26-2)6-8-18/h3-4,9,12,16-17,23H,5-8,10,22H2,1-2H3.
What are the key properties of CID 162563707?
CID 162563707 has a molecular weight of 381.42 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162563707 is sourced from PubChem (CID 162563707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).