1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone

C14H18N4O — CID 92577999

IUPAC1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone
SMILESNC1CCN(C(=O)Cn2ccc3ccncc32)CC1
InChIInChI=1S/C14H18N4O/c15-12-3-7-17(8-4-12)14(19)10-18-6-2-11-1-5-16-9-13(11)18/h1-2,5-6,9,12H,3-4,7-8,10,15H2
InChIKeyDRNZZPZLCLNPTL-UHFFFAOYSA-N
MW258.32 g/mol
LogP0.99
Rot. Bonds2

About 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone

1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone (PubChem CID 92577999) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone.

Molecular Properties

Compound Name1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone
PubChem CID92577999
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone
SMILESNC1CCN(C(=O)Cn2ccc3ccncc32)CC1
InChIInChI=1S/C14H18N4O/c15-12-3-7-17(8-4-12)14(19)10-18-6-2-11-1-5-16-9-13(11)18/h1-2,5-6,9,12H,3-4,7-8,10,15H2
InChIKeyDRNZZPZLCLNPTL-UHFFFAOYSA-N
XLogP0.99
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(pyrrolo[2,3-c]pyridin-1-ylmethyl)cyclohexane-1-carboxylic acid
CID 172581981
1-(4-aminopiperidin-1-yl)-2-pyridin-4-ylethanone
CID 16793351
2-amino-3-methyl-1-[4-(3-pyrrolo[2,3-c]pyridin-1-ylpropanoyl)piperazin-1-yl]butan-1-one
CID 110223895
1-(2-indol-1-ylacetyl)piperidine-4-carbonitrile
CID 49061496
2-indol-1-yl-1-pyrrolidin-1-ylethanone
CID 5191246
1-[3-(diethylaminomethyl)piperidin-1-yl]-3-pyrrolo[2,3-c]pyridin-1-ylpropan-1-one
CID 110223919
1-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-2-indol-1-ylethanone
CID 124758560
1-[4-[(R)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]-2-indol-1-ylethanone
CID 124758561
ethyl 1-[2-(6-fluoroindol-1-yl)acetyl]piperidine-4-carboxylate
CID 29139436
2-indol-1-yl-1-[4-[(3S)-3-methylpiperidine-1-carbonyl]piperidin-1-yl]ethanone
CID 52516114
2-(4-aminopiperidin-1-yl)-1-isoquinolin-8-ylethanone
CID 103133386
(4-aminopiperidin-1-yl)-(3-chloro-4-pyridinyl)methanone
CID 66482030

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone?
The IUPAC name of 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone (CID 92577999) is 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone.
What is the SMILES notation for 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone?
The canonical SMILES for 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone is NC1CCN(C(=O)Cn2ccc3ccncc32)CC1.
What is the InChIKey of 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone?
The InChIKey is DRNZZPZLCLNPTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-12-3-7-17(8-4-12)14(19)10-18-6-2-11-1-5-16-9-13(11)18/h1-2,5-6,9,12H,3-4,7-8,10,15H2.
What are the key properties of 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone?
1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone has a molecular weight of 258.32 g/mol, XLogP of 0.99, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminopiperidin-1-yl)-2-pyrrolo[2,3-c]pyridin-1-ylethanone is sourced from PubChem (CID 92577999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).