CID 143524709

C25H42NO — CID 143524709

IUPAC
SMILESCC1=CC=C(C2CCC(C[C@H](NCC3(C(C)O)CC3)C(C)C)CC2(C)C)[CH]1
InChIInChI=1S/C25H42NO/c1-17(2)23(26-16-25(11-12-25)19(4)27)14-20-8-10-22(24(5,6)15-20)21-9-7-18(3)13-21/h7,9,13,17,19-20,22-23,26-27H,8,10-12,14-16H2,1-6H3/t19?,20?,22?,23-/m0/s1
InChIKeyRWICUNYWBJUQIO-XJBJGSKASA-N
MW372.62 g/mol
LogP5.68
Rot. Bonds8

About CID 143524709

CID 143524709 (PubChem CID 143524709) has the molecular formula C25H42NO and a molecular weight of 372.62 g/mol.

Molecular Properties

Compound NameCID 143524709
PubChem CID143524709
Molecular FormulaC25H42NO
Molecular Weight372.62 g/mol
Exact Mass372.33
IUPAC Name
SMILESCC1=CC=C(C2CCC(C[C@H](NCC3(C(C)O)CC3)C(C)C)CC2(C)C)[CH]1
InChIInChI=1S/C25H42NO/c1-17(2)23(26-16-25(11-12-25)19(4)27)14-20-8-10-22(24(5,6)15-20)21-9-7-18(3)13-21/h7,9,13,17,19-20,22-23,26-27H,8,10-12,14-16H2,1-6H3/t19?,20?,22?,23-/m0/s1
InChIKeyRWICUNYWBJUQIO-XJBJGSKASA-N
XLogP5.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.62
LogP ≤ 55.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 143524709?
The IUPAC name of CID 143524709 (CID 143524709) is not available.
What is the SMILES notation for CID 143524709?
The canonical SMILES for CID 143524709 is CC1=CC=C(C2CCC(C[C@H](NCC3(C(C)O)CC3)C(C)C)CC2(C)C)[CH]1.
What is the InChIKey of CID 143524709?
The InChIKey is RWICUNYWBJUQIO-XJBJGSKASA-N. The full InChI is InChI=1S/C25H42NO/c1-17(2)23(26-16-25(11-12-25)19(4)27)14-20-8-10-22(24(5,6)15-20)21-9-7-18(3)13-21/h7,9,13,17,19-20,22-23,26-27H,8,10-12,14-16H2,1-6H3/t19?,20?,22?,23-/m0/s1.
What are the key properties of CID 143524709?
CID 143524709 has a molecular weight of 372.62 g/mol, XLogP of 5.68, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 143524709 is sourced from PubChem (CID 143524709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).