(5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene

C19H25N — CID 145444914

IUPAC(5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene
SMILESCC1/C=C\C=C/CCN(C)C2=C=C(C=CC=C2)C1(C)C
InChIInChI=1S/C19H25N/c1-16-11-7-5-6-10-14-20(4)18-13-9-8-12-17(15-18)19(16,2)3/h5-9,11-13,16H,10,14H2,1-4H3/b6-5-,11-7-
InChIKeyAHONESADJGPZEA-FUVGTJSASA-N
MW267.42 g/mol
LogP4.63
Rot. Bonds

About (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene

(5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene (PubChem CID 145444914) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene.

Molecular Properties

Compound Name(5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene
PubChem CID145444914
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name(5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene
SMILESCC1/C=C\C=C/CCN(C)C2=C=C(C=CC=C2)C1(C)C
InChIInChI=1S/C19H25N/c1-16-11-7-5-6-10-14-20(4)18-13-9-8-12-17(15-18)19(16,2)3/h5-9,11-13,16H,10,14H2,1-4H3/b6-5-,11-7-
InChIKeyAHONESADJGPZEA-FUVGTJSASA-N
XLogP4.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene with MolForge

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Related Compounds

N-[1-(4-ethyl-5-methylcyclohepta-1,3,6-trien-1-yl)ethenyl]-2-fluoro-N,2-dimethylpentan-3-amine
CID 156543753
4-tert-butyl-N-cyclohexa-1,3-dien-1-yl-N-cyclohexa-2,4-dien-1-ylcyclohexa-1,5-dien-1-amine
CID 59523998
1,5-ditert-butyl-6-propan-2-yl-2H-pyridine
CID 59616752
3,7,7,12,13-Pentamethyl-3-azatricyclo[9.1.1.02,8]trideca-2(8),9-diene
CID 71119974
(4R)-6-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-1,4,5,5,7-pentamethyl-3,4-dihydro-2H-azepine
CID 71119975
(4R)-1,4,5,5,7-pentamethyl-6-[(Z)-4-methylhept-1-enyl]-3,4-dihydro-2H-azepine
CID 71119976
3,6,7,7,12,13-Hexamethyl-3-azatricyclo[9.1.1.02,8]trideca-2(8),9-diene
CID 71119977
(6R)-3,6,7,7,12,13-hexamethyl-3-azatricyclo[9.1.1.02,8]trideca-2(8),9-diene
CID 71119978
7-(2,4-dimethylpentyl)-1,5,5-trimethyl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-azepine
CID 71119988
(4R)-6-[(Z)-5,5-dimethylhex-1-enyl]-1,4,5,5,7-pentamethyl-3,4-dihydro-2H-azepine
CID 71119994
1,5,5,7-tetramethyl-6-[(Z)-2-(2-methylcyclobutyl)ethenyl]-3,4-dihydro-2H-azepine
CID 71119995
6-[(Z)-2-(2,4-dimethylcyclobutyl)ethenyl]-1,5,5,7-tetramethyl-3,4-dihydro-2H-azepine
CID 71119999

Frequently Asked Questions

What is the IUPAC name of (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene?
The IUPAC name of (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene (CID 145444914) is (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene.
What is the SMILES notation for (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene?
The canonical SMILES for (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene is CC1/C=C\C=C/CCN(C)C2=C=C(C=CC=C2)C1(C)C.
What is the InChIKey of (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene?
The InChIKey is AHONESADJGPZEA-FUVGTJSASA-N. The full InChI is InChI=1S/C19H25N/c1-16-11-7-5-6-10-14-20(4)18-13-9-8-12-17(15-18)19(16,2)3/h5-9,11-13,16H,10,14H2,1-4H3/b6-5-,11-7-.
What are the key properties of (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene?
(5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene has a molecular weight of 267.42 g/mol, XLogP of 4.63, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z,7Z)-2,9,10,10-tetramethyl-2-azabicyclo[9.4.1]hexadeca-1(16),5,7,11(16),12,14-hexaene is sourced from PubChem (CID 145444914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).