N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide

C19H25N3O2 — CID 69451477

IUPACN-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide
SMILESCC(=O)NC1CCN(CCCn2cc(C(C)=O)c3ccccc32)C1
InChIInChI=1S/C19H25N3O2/c1-14(23)18-13-22(19-7-4-3-6-17(18)19)10-5-9-21-11-8-16(12-21)20-15(2)24/h3-4,6-7,13,16H,5,8-12H2,1-2H3,(H,20,24)
InChIKeyFRVNZQKIJNPOPE-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.44
Rot. Bonds6

About N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide

N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide (PubChem CID 69451477) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide
PubChem CID69451477
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide
SMILESCC(=O)NC1CCN(CCCn2cc(C(C)=O)c3ccccc32)C1
InChIInChI=1S/C19H25N3O2/c1-14(23)18-13-22(19-7-4-3-6-17(18)19)10-5-9-21-11-8-16(12-21)20-15(2)24/h3-4,6-7,13,16H,5,8-12H2,1-2H3,(H,20,24)
InChIKeyFRVNZQKIJNPOPE-UHFFFAOYSA-N
XLogP2.44
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[3-[4-(cyclopropylmethoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone
CID 23641881
N-[1-(3-phenylpropyl)piperidin-3-yl]acetamide
CID 171328429
1-[1-[4-(4-benzylpiperidin-1-yl)butyl]indol-3-yl]ethanone;1-[1-[3-(4-benzylpiperidin-1-yl)propyl]indol-3-yl]-2,2,2-trifluoroethanone;ethyl 1-[2-(3-acetylindol-1-yl)ethyl]piperidine-4-carboxylate;ethyl 1-[3-[3-(2,2,2-trifluoroacetyl)indol-1-yl]propyl]piperidine-4-carboxylate
CID 157365600
1-[1-[3-(4-benzoylpiperidin-1-yl)propyl]-5-methoxyindol-3-yl]ethanone
CID 23641667
N-[1-(3-methylbut-2-enyl)piperidin-4-yl]-1-(2-methylpropyl)indole-3-carboxamide
CID 56568890
1-[1-[4-[3-(cyclopropylmethoxy)-8-azabicyclo[3.2.1]octan-8-yl]butyl]indol-3-yl]ethanone
CID 58968275
3-(3-acetylindol-1-yl)-N-(1-methylpyrazol-4-yl)propanamide
CID 56762237
N-[1-(2,3-dihydro-1-benzothiophen-3-ylmethyl)pyrrolidin-3-yl]acetamide
CID 113402624
methyl 1-[3-[4-(2-hydroxyphenyl)piperazin-1-yl]propyl]indole-3-carboxylate
CID 69444934
[(3R)-1-(3-phenylpropyl)pyrrolidin-3-yl]carbamic acid
CID 154457780
1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]propan-1-one
CID 58967722
1-[1-[4-[1-(4-fluorophenyl)azepan-4-yl]butyl]indol-3-yl]ethanone
CID 143502496

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide?
The IUPAC name of N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide (CID 69451477) is N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide is CC(=O)NC1CCN(CCCn2cc(C(C)=O)c3ccccc32)C1.
What is the InChIKey of N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide?
The InChIKey is FRVNZQKIJNPOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14(23)18-13-22(19-7-4-3-6-17(18)19)10-5-9-21-11-8-16(12-21)20-15(2)24/h3-4,6-7,13,16H,5,8-12H2,1-2H3,(H,20,24).
What are the key properties of N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide?
N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide has a molecular weight of 327.43 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(3-acetylindol-1-yl)propyl]pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 69451477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).