CID 134902420

C24H37Nb — CID 134902420

IUPAC—
SMILESC[C]1[C](C)[C](C)[C](C)[C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[CH2][CH][CH]C.[Nb]
InChIInChI=1S/2C10H15.C4H7.Nb/c2*1-6-7(2)9(4)10(5)8(6)3;1-3-4-2;/h2*1-5H3;3-4H,1H2,2H3;
InChIKeyQTLUZTWDZQHQNE-UHFFFAOYSA-N
MW418.47 g/mol
LogP7.19
Rot. Bonds1

About CID 134902420

CID 134902420 (PubChem CID 134902420) has the molecular formula C24H37Nb and a molecular weight of 418.47 g/mol.

Molecular Properties

Compound NameCID 134902420
PubChem CID134902420
Molecular FormulaC24H37Nb
Molecular Weight418.47 g/mol
Exact Mass418.20
IUPAC Name—
SMILESC[C]1[C](C)[C](C)[C](C)[C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[CH2][CH][CH]C.[Nb]
InChIInChI=1S/2C10H15.C4H7.Nb/c2*1-6-7(2)9(4)10(5)8(6)3;1-3-4-2;/h2*1-5H3;3-4H,1H2,2H3;
InChIKeyQTLUZTWDZQHQNE-UHFFFAOYSA-N
XLogP7.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.47
LogP ≤ 57.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 134902420?
The IUPAC name of CID 134902420 (CID 134902420) is not available.
What is the SMILES notation for CID 134902420?
The canonical SMILES for CID 134902420 is C[C]1[C](C)[C](C)[C](C)[C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[CH2][CH][CH]C.[Nb].
What is the InChIKey of CID 134902420?
The InChIKey is QTLUZTWDZQHQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H15.C4H7.Nb/c2*1-6-7(2)9(4)10(5)8(6)3;1-3-4-2;/h2*1-5H3;3-4H,1H2,2H3;.
What are the key properties of CID 134902420?
CID 134902420 has a molecular weight of 418.47 g/mol, XLogP of 7.19, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134902420 is sourced from PubChem (CID 134902420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).