N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide

C18H17N3O2 — CID 158644717

IUPACN-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide
SMILESCOc1ccc(-c2cccnc2)c2c1CC(NC(=O)C1CC1)=N2
InChIInChI=1S/C18H17N3O2/c1-23-15-7-6-13(12-3-2-8-19-10-12)17-14(15)9-16(20-17)21-18(22)11-4-5-11/h2-3,6-8,10-11H,4-5,9H2,1H3,(H,20,21,22)
InChIKeyIAVADNCLAAQCNZ-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.87
Rot. Bonds3

About N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide

N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide (PubChem CID 158644717) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide
PubChem CID158644717
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide
SMILESCOc1ccc(-c2cccnc2)c2c1CC(NC(=O)C1CC1)=N2
InChIInChI=1S/C18H17N3O2/c1-23-15-7-6-13(12-3-2-8-19-10-12)17-14(15)9-16(20-17)21-18(22)11-4-5-11/h2-3,6-8,10-11H,4-5,9H2,1H3,(H,20,21,22)
InChIKeyIAVADNCLAAQCNZ-UHFFFAOYSA-N
XLogP2.87
TPSA63.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[7-(2,6-dimethoxy-3-pyridinyl)-4-methoxy-3H-indol-2-yl]cyclopropanecarboxamide
CID 157498367
methyl 4-methoxy-3-pyridin-3-ylbenzoate
CID 46317451
3-(2-methoxyphenyl)pyridine
CID 4133297
N-(4-methoxy-7-pyridin-4-yl-3H-indol-2-yl)-2-oxa-7-azaspiro[3.4]octane-7-carboxamide
CID 159878969
2-(cyclopropanecarbonylamino)-3-(4-pyridin-3-yl-3-pyridinyl)pyridine-4-carboxamide
CID 142796572
2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide
CID 154762622
5-(cyclopropanecarbonylamino)-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid
CID 142773853
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
CID 156631933
3-(2,4-dimethoxyphenyl)pyridine
CID 46316965
2-[5-(cyclopropanecarbonylamino)-3-pyridin-3-yl-1,2-oxazol-4-yl]benzoic acid
CID 175242426
N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide
CID 2852997
4-hydroxy-N-pyridin-3-ylcyclohexane-1-carboxamide
CID 112524091

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide (CID 158644717) is N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide is COc1ccc(-c2cccnc2)c2c1CC(NC(=O)C1CC1)=N2.
What is the InChIKey of N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide?
The InChIKey is IAVADNCLAAQCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-23-15-7-6-13(12-3-2-8-19-10-12)17-14(15)9-16(20-17)21-18(22)11-4-5-11/h2-3,6-8,10-11H,4-5,9H2,1H3,(H,20,21,22).
What are the key properties of N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide?
N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide has a molecular weight of 307.35 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-7-pyridin-3-yl-3H-indol-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 158644717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).