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

C24H26N4O — CID 3262286

IUPAC6,7,12,15,15-pentamethyl-N-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide
SMILESCc1cc2nc3c(nc2cc1C)C1(C(=O)Nc2ccccn2)CCC3(C)C1(C)C
InChIInChI=1S/C24H26N4O/c1-14-12-16-17(13-15(14)2)27-20-19(26-16)23(5)9-10-24(20,22(23,3)4)21(29)28-18-8-6-7-11-25-18/h6-8,11-13H,9-10H2,1-5H3,(H,25,28,29)
InChIKeyXGZFNRCROKGGOK-UHFFFAOYSA-N
MW386.50 g/mol
LogP4.61
Rot. Bonds2

About 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-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-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide (PubChem CID 3262286) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-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-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide
PubChem CID3262286
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name6,7,12,15,15-pentamethyl-N-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide
SMILESCc1cc2nc3c(nc2cc1C)C1(C(=O)Nc2ccccn2)CCC3(C)C1(C)C
InChIInChI=1S/C24H26N4O/c1-14-12-16-17(13-15(14)2)27-20-19(26-16)23(5)9-10-24(20,22(23,3)4)21(29)28-18-8-6-7-11-25-18/h6-8,11-13H,9-10H2,1-5H3,(H,25,28,29)
InChIKeyXGZFNRCROKGGOK-UHFFFAOYSA-N
XLogP4.61
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-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-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide (CID 3262286) is 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-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-pyridin-2-yl-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-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide is Cc1cc2nc3c(nc2cc1C)C1(C(=O)Nc2ccccn2)CCC3(C)C1(C)C.
What is the InChIKey of 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-3,10-diazatetracyclo[10.2.1.02,11.04,9]pentadeca-2,4(9),5,7,10-pentaene-1-carboxamide?
The InChIKey is XGZFNRCROKGGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c1-14-12-16-17(13-15(14)2)27-20-19(26-16)23(5)9-10-24(20,22(23,3)4)21(29)28-18-8-6-7-11-25-18/h6-8,11-13H,9-10H2,1-5H3,(H,25,28,29).
What are the key properties of 6,7,12,15,15-pentamethyl-N-pyridin-2-yl-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-pyridin-2-yl-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 386.50 g/mol, XLogP of 4.61, 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-pyridin-2-yl-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 3262286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).