N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide

C17H18N4O — CID 28736534

IUPACN-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide
SMILESO=C(CCc1cnccn1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C17H18N4O/c22-17(6-5-14-12-18-9-10-19-14)20-8-7-13-11-21-16-4-2-1-3-15(13)16/h1-4,9-12,21H,5-8H2,(H,20,22)
InChIKeyPIRPWNXKNGSHHV-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.25
Rot. Bonds6

About N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide

N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide (PubChem CID 28736534) has the molecular formula C17H18N4O and a molecular weight of 294.36 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide
PubChem CID28736534
Molecular FormulaC17H18N4O
Molecular Weight294.36 g/mol
Exact Mass294.15
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide
SMILESO=C(CCc1cnccn1)NCCc1c[nH]c2ccccc12
InChIInChI=1S/C17H18N4O/c22-17(6-5-14-12-18-9-10-19-14)20-8-7-13-11-21-16-4-2-1-3-15(13)16/h1-4,9-12,21H,5-8H2,(H,20,22)
InChIKeyPIRPWNXKNGSHHV-UHFFFAOYSA-N
XLogP2.25
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-chloro-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 588711
N-[2-(1H-indol-3-yl)ethyl]-3-(2-methyl-1,3-oxazol-4-yl)propanamide
CID 110679216
3-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide
CID 4806902
4-[2-(1H-indol-3-yl)ethylamino]-4-oxobutanoate
CID 7019224
3-(1,3-dioxopyrrolo[3,4-c]pyridin-2-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 71754941
4-(1H-indol-3-yl)-N-[2-[3-(1H-indol-3-yl)propanoylamino]ethyl]butanamide
CID 42506947
3-(4-aminophenyl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 28712929
3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide
CID 4879910
N-[2-(1H-indol-3-yl)ethyl]-3-(4-methylphenyl)propanamide
CID 16574540
6-amino-N-[2-(1H-indol-3-yl)ethyl]hexanamide
CID 61259839
3-(1H-indol-3-yl)-N-(2-sulfamoylethyl)propanamide
CID 43582891

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide (CID 28736534) is N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide is O=C(CCc1cnccn1)NCCc1c[nH]c2ccccc12.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
The InChIKey is PIRPWNXKNGSHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O/c22-17(6-5-14-12-18-9-10-19-14)20-8-7-13-11-21-16-4-2-1-3-15(13)16/h1-4,9-12,21H,5-8H2,(H,20,22).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide has a molecular weight of 294.36 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide is sourced from PubChem (CID 28736534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).