4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide

C17H15N3O2 — CID 163634647

IUPAC4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide
SMILESC=C(OC)c1cncc(-c2ccc(C(N)=O)c3[nH]ccc23)c1
InChIInChI=1S/C17H15N3O2/c1-10(22-2)11-7-12(9-19-8-11)13-3-4-15(17(18)21)16-14(13)5-6-20-16/h3-9,20H,1H2,2H3,(H2,18,21)
InChIKeyHZAWBCGKGLOQBP-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.95
Rot. Bonds4

About 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide

4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide (PubChem CID 163634647) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide.

Molecular Properties

Compound Name4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide
PubChem CID163634647
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide
SMILESC=C(OC)c1cncc(-c2ccc(C(N)=O)c3[nH]ccc23)c1
InChIInChI=1S/C17H15N3O2/c1-10(22-2)11-7-12(9-19-8-11)13-3-4-15(17(18)21)16-14(13)5-6-20-16/h3-9,20H,1H2,2H3,(H2,18,21)
InChIKeyHZAWBCGKGLOQBP-UHFFFAOYSA-N
XLogP2.95
TPSA81.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

5-[6-(2-methoxyethylamino)-1H-pyrrolo[2,3-b]pyridin-4-yl]pyridine-3-carboxamide
CID 56901483
4-[3-[3-(aminomethyl)-2-oxobut-3-enyl]phenyl]-1H-indole-7-carboxamide
CID 158596420
4-[2-(2-oxobut-3-enyl)-4-pyridinyl]-1H-indole-7-carboxamide
CID 161253252
4-[3-[[(Z)-but-2-enoyl]amino]phenyl]-1H-indole-7-carboxamide
CID 141436482
N-[5-(7-formamido-1H-indol-4-yl)-3-pyridinyl]prop-2-enamide
CID 174972688
ethyl 5-(1H-indol-4-yl)pyridine-3-carboxylate
CID 10491979
4-[4-(aminomethyl)phenyl]-1H-indole-7-carboxamide;1H-azet-2-one
CID 174783814
5-(2,3,4-trimethoxyphenyl)pyridine-3-carboxylic acid
CID 39233473
1H-pyrrolo[3,2-c]pyridine-7-carboxamide
CID 67034068
4-[3-[buta-1,3-dien-2-yl(cyclopentylmethyl)amino]phenyl]-1H-indole-7-carboxamide
CID 138641428
4-amino-1H-indole-7-carbonitrile;4-amino-1H-indole-7-carboxamide
CID 161183208
2-methoxy-4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)benzamide
CID 167773837

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide?
The IUPAC name of 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide (CID 163634647) is 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide.
What is the SMILES notation for 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide?
The canonical SMILES for 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide is C=C(OC)c1cncc(-c2ccc(C(N)=O)c3[nH]ccc23)c1.
What is the InChIKey of 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide?
The InChIKey is HZAWBCGKGLOQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-10(22-2)11-7-12(9-19-8-11)13-3-4-15(17(18)21)16-14(13)5-6-20-16/h3-9,20H,1H2,2H3,(H2,18,21).
What are the key properties of 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide?
4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1-methoxyethenyl)-3-pyridinyl]-1H-indole-7-carboxamide is sourced from PubChem (CID 163634647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).