6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide

C25H28N4O — CID 3254134

IUPAC6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide
SMILESCc1cccc(NC(=O)C23CCC(C)(c4nc5cc(C)c(C)cc5nc42)C3(C)C)n1
InChIInChI=1S/C25H28N4O/c1-14-12-17-18(13-15(14)2)28-21-20(27-17)24(6)10-11-25(21,23(24,4)5)22(30)29-19-9-7-8-16(3)26-19/h7-9,12-13H,10-11H2,1-6H3,(H,26,29,30)
InChIKeyLGMNAMPAKBAPEB-UHFFFAOYSA-N
MW400.53 g/mol
LogP4.92
Rot. Bonds2

About 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide

6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide (PubChem CID 3254134) has the molecular formula C25H28N4O and a molecular weight of 400.53 g/mol. Its IUPAC name is 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide.

Molecular Properties

Compound Name6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide
PubChem CID3254134
Molecular FormulaC25H28N4O
Molecular Weight400.53 g/mol
Exact Mass400.23
IUPAC Name6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide
SMILESCc1cccc(NC(=O)C23CCC(C)(c4nc5cc(C)c(C)cc5nc42)C3(C)C)n1
InChIInChI=1S/C25H28N4O/c1-14-12-17-18(13-15(14)2)28-21-20(27-17)24(6)10-11-25(21,23(24,4)5)22(30)29-19-9-7-8-16(3)26-19/h7-9,12-13H,10-11H2,1-6H3,(H,26,29,30)
InChIKeyLGMNAMPAKBAPEB-UHFFFAOYSA-N
XLogP4.92
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.53
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide 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 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide?
The IUPAC name of 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide (CID 3254134) is 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide.
What is the SMILES notation for 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide?
The canonical SMILES for 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide is Cc1cccc(NC(=O)C23CCC(C)(c4nc5cc(C)c(C)cc5nc42)C3(C)C)n1.
What is the InChIKey of 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide?
The InChIKey is LGMNAMPAKBAPEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O/c1-14-12-17-18(13-15(14)2)28-21-20(27-17)24(6)10-11-25(21,23(24,4)5)22(30)29-19-9-7-8-16(3)26-19/h7-9,12-13H,10-11H2,1-6H3,(H,26,29,30).
What are the key properties of 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide?
6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide has a molecular weight of 400.53 g/mol, XLogP of 4.92, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,12,15,15-pentamethyl-N-(6-methyl-2-pyridinyl)-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide is sourced from PubChem (CID 3254134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).