(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene

C19H26N2 — CID 19879755

IUPAC(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
SMILESCCC1C2CC3=C(CCC4=C3/C=C\N/C=C\C41CC)N2C
InChIInChI=1S/C19H26N2/c1-4-15-18-12-14-13-8-10-20-11-9-19(15,5-2)16(13)6-7-17(14)21(18)3/h8-11,15,18,20H,4-7,12H2,1-3H3/b10-8-,11-9-
InChIKeyDCXQWWZLKGKADL-WGEIWTTOSA-N
MW282.43 g/mol
LogP4.10
Rot. Bonds2

About (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene

(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene (PubChem CID 19879755) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene.

Molecular Properties

Compound Name(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
PubChem CID19879755
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene
SMILESCCC1C2CC3=C(CCC4=C3/C=C\N/C=C\C41CC)N2C
InChIInChI=1S/C19H26N2/c1-4-15-18-12-14-13-8-10-20-11-9-19(15,5-2)16(13)6-7-17(14)21(18)3/h8-11,15,18,20H,4-7,12H2,1-3H3/b10-8-,11-9-
InChIKeyDCXQWWZLKGKADL-WGEIWTTOSA-N
XLogP4.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene?
The IUPAC name of (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene (CID 19879755) is (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene.
What is the SMILES notation for (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene?
The canonical SMILES for (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene is CCC1C2CC3=C(CCC4=C3/C=C\N/C=C\C41CC)N2C.
What is the InChIKey of (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene?
The InChIKey is DCXQWWZLKGKADL-WGEIWTTOSA-N. The full InChI is InChI=1S/C19H26N2/c1-4-15-18-12-14-13-8-10-20-11-9-19(15,5-2)16(13)6-7-17(14)21(18)3/h8-11,15,18,20H,4-7,12H2,1-3H3/b10-8-,11-9-.
What are the key properties of (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene?
(5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene has a molecular weight of 282.43 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,8Z)-10,16-diethyl-15-methyl-7,15-diazatetracyclo[8.5.1.03,14.04,11]hexadeca-3(14),4(11),5,8-tetraene is sourced from PubChem (CID 19879755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).