N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide

C20H23N5O — CID 71867008

IUPACN-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SMILESO=C(CCN1CCN(c2ccccn2)CC1)Nc1ccc2[nH]ccc2c1
InChIInChI=1S/C20H23N5O/c26-20(23-17-4-5-18-16(15-17)6-9-21-18)7-10-24-11-13-25(14-12-24)19-3-1-2-8-22-19/h1-6,8-9,15,21H,7,10-14H2,(H,23,26)
InChIKeyFAGVKTVDNOABSR-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.71
Rot. Bonds5

About N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide

N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide (PubChem CID 71867008) has the molecular formula C20H23N5O and a molecular weight of 349.44 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide.

Molecular Properties

Compound NameN-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
PubChem CID71867008
Molecular FormulaC20H23N5O
Molecular Weight349.44 g/mol
Exact Mass349.19
IUPAC NameN-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
SMILESO=C(CCN1CCN(c2ccccn2)CC1)Nc1ccc2[nH]ccc2c1
InChIInChI=1S/C20H23N5O/c26-20(23-17-4-5-18-16(15-17)6-9-21-18)7-10-24-11-13-25(14-12-24)19-3-1-2-8-22-19/h1-6,8-9,15,21H,7,10-14H2,(H,23,26)
InChIKeyFAGVKTVDNOABSR-UHFFFAOYSA-N
XLogP2.71
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 109030344
N-(1,3-benzodioxol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 13210213
N-[4-(dimethylamino)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 6259677
N-(9-ethylcarbazol-3-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 22458846
(3aR,6aS)-N-(1H-indol-5-yl)-5-pyridin-2-yl-3a,4,6,6a-tetrahydropyrrolo[3,4-d][1,2]oxazole-3-carboxamide
CID 134809311
N-(3-acetamidophenyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 109030558
3-(4-pyridin-2-ylpiperazin-1-yl)propanamide;dihydrochloride
CID 11971564
N-[2-(ethylaminomethyl)phenyl]-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 119438834
4-(1H-indol-5-ylamino)-4-oxobutanoic acid
CID 54867490
(2S)-3-phenyl-2-[3-(4-pyridin-2-ylpiperazin-1-yl)propanoylamino]propanoic acid
CID 119366582
N-(3-fluoro-4-methylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4566699
N-(3-chloro-4-cyanophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 5043291

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
The IUPAC name of N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide (CID 71867008) is N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide.
What is the SMILES notation for N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
The canonical SMILES for N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide is O=C(CCN1CCN(c2ccccn2)CC1)Nc1ccc2[nH]ccc2c1.
What is the InChIKey of N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
The InChIKey is FAGVKTVDNOABSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O/c26-20(23-17-4-5-18-16(15-17)6-9-21-18)7-10-24-11-13-25(14-12-24)19-3-1-2-8-22-19/h1-6,8-9,15,21H,7,10-14H2,(H,23,26).
What are the key properties of N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide?
N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide has a molecular weight of 349.44 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide is sourced from PubChem (CID 71867008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).