1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole

C19H20N2 — CID 130450233

IUPAC1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole
SMILESC/C=C\c1c(C)n(-c2cc(C)cc(C)n2)c2ccccc12
InChIInChI=1S/C19H20N2/c1-5-8-16-15(4)21(18-10-7-6-9-17(16)18)19-12-13(2)11-14(3)20-19/h5-12H,1-4H3/b8-5-
InChIKeyMNOVPFQJIXTHTO-YVMONPNESA-N
MW276.38 g/mol
LogP4.98
Rot. Bonds2

About 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole

1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole (PubChem CID 130450233) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole.

Molecular Properties

Compound Name1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole
PubChem CID130450233
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole
SMILESC/C=C\c1c(C)n(-c2cc(C)cc(C)n2)c2ccccc12
InChIInChI=1S/C19H20N2/c1-5-8-16-15(4)21(18-10-7-6-9-17(16)18)19-12-13(2)11-14(3)20-19/h5-12H,1-4H3/b8-5-
InChIKeyMNOVPFQJIXTHTO-YVMONPNESA-N
XLogP4.98
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole?
The IUPAC name of 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole (CID 130450233) is 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole.
What is the SMILES notation for 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole?
The canonical SMILES for 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole is C/C=C\c1c(C)n(-c2cc(C)cc(C)n2)c2ccccc12.
What is the InChIKey of 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole?
The InChIKey is MNOVPFQJIXTHTO-YVMONPNESA-N. The full InChI is InChI=1S/C19H20N2/c1-5-8-16-15(4)21(18-10-7-6-9-17(16)18)19-12-13(2)11-14(3)20-19/h5-12H,1-4H3/b8-5-.
What are the key properties of 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole?
1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole has a molecular weight of 276.38 g/mol, XLogP of 4.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethyl-2-pyridinyl)-2-methyl-3-[(Z)-prop-1-enyl]indole is sourced from PubChem (CID 130450233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).