trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane

C28H31GeN — CID 171764430

IUPACtrimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane
SMILESCc1cc([Ge](C)(C)C)ccc1-c1ccnc(-c2cc(C(C)C)c3ccccc3c2)c1
InChIInChI=1S/C28H31GeN/c1-19(2)27-17-23(16-21-9-7-8-10-26(21)27)28-18-22(13-14-30-28)25-12-11-24(15-20(25)3)29(4,5)6/h7-19H,1-6H3
InChIKeyAZJCDWYYMHPVIU-UHFFFAOYSA-N
MW454.17 g/mol
LogP7.55
Rot. Bonds4

About trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane

trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane (PubChem CID 171764430) has the molecular formula C28H31GeN and a molecular weight of 454.17 g/mol. Its IUPAC name is trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane.

Molecular Properties

Compound Nametrimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane
PubChem CID171764430
Molecular FormulaC28H31GeN
Molecular Weight454.17 g/mol
Exact Mass455.17
IUPAC Nametrimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane
SMILESCc1cc([Ge](C)(C)C)ccc1-c1ccnc(-c2cc(C(C)C)c3ccccc3c2)c1
InChIInChI=1S/C28H31GeN/c1-19(2)27-17-23(16-21-9-7-8-10-26(21)27)28-18-22(13-14-30-28)25-12-11-24(15-20(25)3)29(4,5)6/h7-19H,1-6H3
InChIKeyAZJCDWYYMHPVIU-UHFFFAOYSA-N
XLogP7.55
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.17
LogP ≤ 57.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane?
The IUPAC name of trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane (CID 171764430) is trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane.
What is the SMILES notation for trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane?
The canonical SMILES for trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane is Cc1cc([Ge](C)(C)C)ccc1-c1ccnc(-c2cc(C(C)C)c3ccccc3c2)c1.
What is the InChIKey of trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane?
The InChIKey is AZJCDWYYMHPVIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H31GeN/c1-19(2)27-17-23(16-21-9-7-8-10-26(21)27)28-18-22(13-14-30-28)25-12-11-24(15-20(25)3)29(4,5)6/h7-19H,1-6H3.
What are the key properties of trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane?
trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane has a molecular weight of 454.17 g/mol, XLogP of 7.55, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-methyl-4-[2-(4-propan-2-ylnaphthalen-2-yl)-4-pyridinyl]phenyl]germane is sourced from PubChem (CID 171764430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).