4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide

C16H15N3O2 — CID 4910202

IUPAC4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
SMILESCOc1cccc2[nH]c(C(=O)NCc3cccnc3)cc12
InChIInChI=1S/C16H15N3O2/c1-21-15-6-2-5-13-12(15)8-14(19-13)16(20)18-10-11-4-3-7-17-9-11/h2-9,19H,10H2,1H3,(H,18,20)
InChIKeyALZMUJBBWHBGJM-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.50
Rot. Bonds4

About 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide

4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide (PubChem CID 4910202) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
PubChem CID4910202
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
SMILESCOc1cccc2[nH]c(C(=O)NCc3cccnc3)cc12
InChIInChI=1S/C16H15N3O2/c1-21-15-6-2-5-13-12(15)8-14(19-13)16(20)18-10-11-4-3-7-17-9-11/h2-9,19H,10H2,1H3,(H,18,20)
InChIKeyALZMUJBBWHBGJM-UHFFFAOYSA-N
XLogP2.50
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-[[(1S)-1-cyano-2-pyridin-3-ylethyl]amino]-4-methyl-1-oxopentan-2-yl]-4-methoxy-1H-indole-2-carboxamide
CID 162396201
N-phenyl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1H-indole-2-carboxamide
CID 46934765
1-N-[2-(2-methoxyphenyl)ethyl]-3-N-(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide
CID 109055063
2-bromo-N-(pyridin-3-ylmethyl)-4H-furo[3,2-b]pyrrole-5-carboxamide
CID 91961363
7-methyl-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide
CID 110852008
2-methoxy-5-(pyridin-3-ylmethylcarbamoyl)benzoyl chloride
CID 71429785
N-[(3,4-dimethoxyphenyl)methyl]-N'-(pyridin-3-ylmethyl)propanediamide
CID 108947614
1-[2-(2,3-dimethoxyphenoxy)ethyl]-3-(pyridin-3-ylmethyl)urea
CID 112975469
N-[1-[[1-cyano-2-(2-oxopyrrolidin-3-yl)ethyl]amino]-1-oxo-3-pyridin-3-ylpropan-2-yl]-4-methoxy-1H-indole-2-carboxamide
CID 166749439
3-methoxy-4-prop-2-enoxy-N-(pyridin-3-ylmethyl)benzamide
CID 24538483
3,4,5-trimethoxy-N-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 2803194
N-[(3,4,5-trimethoxyphenyl)methyl]-1H-indole-2-carboxamide
CID 9483409

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide?
The IUPAC name of 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide (CID 4910202) is 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide is COc1cccc2[nH]c(C(=O)NCc3cccnc3)cc12.
What is the InChIKey of 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide?
The InChIKey is ALZMUJBBWHBGJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-21-15-6-2-5-13-12(15)8-14(19-13)16(20)18-10-11-4-3-7-17-9-11/h2-9,19H,10H2,1H3,(H,18,20).
What are the key properties of 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide?
4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 2.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 4910202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).