3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide

C20H22N4O — CID 154847663

IUPAC3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide
SMILESCn1cc(CCC(=O)NC2CN(c3ccccn3)C2)c2ccccc21
InChIInChI=1S/C20H22N4O/c1-23-12-15(17-6-2-3-7-18(17)23)9-10-20(25)22-16-13-24(14-16)19-8-4-5-11-21-19/h2-8,11-12,16H,9-10,13-14H2,1H3,(H,22,25)
InChIKeyQVZDAMVMBKWTKZ-UHFFFAOYSA-N
MW334.42 g/mol
LogP2.51
Rot. Bonds5

About 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide

3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide (PubChem CID 154847663) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide.

Molecular Properties

Compound Name3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide
PubChem CID154847663
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide
SMILESCn1cc(CCC(=O)NC2CN(c3ccccn3)C2)c2ccccc21
InChIInChI=1S/C20H22N4O/c1-23-12-15(17-6-2-3-7-18(17)23)9-10-20(25)22-16-13-24(14-16)19-8-4-5-11-21-19/h2-8,11-12,16H,9-10,13-14H2,1H3,(H,22,25)
InChIKeyQVZDAMVMBKWTKZ-UHFFFAOYSA-N
XLogP2.51
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cis-(1R,3S)-3-[3-(1-methylindol-3-yl)propanoylamino]cyclopentane-1-carboxylic acid
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3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
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N-ethyl-3-(1-methylindol-3-yl)propanamide
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3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
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3-(1-methylindol-3-yl)-N-(2-methyl-1,2,4-triazol-3-yl)propanamide
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3-(2-methoxynaphthalen-1-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621287
N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide
CID 71913209
1-cyclopentyl-3-[2-(1-methylindol-3-yl)ethyl]urea
CID 110748890
3-(3-methylthiophen-2-yl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621291
3-(3,4-dichlorophenyl)-N-(1-pyridin-2-ylpyrrolidin-3-yl)propanamide
CID 90621285
4-(1-methylindol-3-yl)butanamide
CID 175206986

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide?
The IUPAC name of 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide (CID 154847663) is 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide.
What is the SMILES notation for 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide?
The canonical SMILES for 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide is Cn1cc(CCC(=O)NC2CN(c3ccccn3)C2)c2ccccc21.
What is the InChIKey of 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide?
The InChIKey is QVZDAMVMBKWTKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c1-23-12-15(17-6-2-3-7-18(17)23)9-10-20(25)22-16-13-24(14-16)19-8-4-5-11-21-19/h2-8,11-12,16H,9-10,13-14H2,1H3,(H,22,25).
What are the key properties of 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide?
3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide has a molecular weight of 334.42 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide is sourced from PubChem (CID 154847663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).