2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide

C19H23N5O — CID 155961802

IUPAC2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide
SMILESCn1cc(NC(=O)CN2CCCCC2c2cc3ccccc3[nH]2)cn1
InChIInChI=1S/C19H23N5O/c1-23-12-15(11-20-23)21-19(25)13-24-9-5-4-8-18(24)17-10-14-6-2-3-7-16(14)22-17/h2-3,6-7,10-12,18,22H,4-5,8-9,13H2,1H3,(H,21,25)
InChIKeyIZAJTASQBRSCKO-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.07
Rot. Bonds4

About 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide

2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide (PubChem CID 155961802) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide
PubChem CID155961802
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide
SMILESCn1cc(NC(=O)CN2CCCCC2c2cc3ccccc3[nH]2)cn1
InChIInChI=1S/C19H23N5O/c1-23-12-15(11-20-23)21-19(25)13-24-9-5-4-8-18(24)17-10-14-6-2-3-7-16(14)22-17/h2-3,6-7,10-12,18,22H,4-5,8-9,13H2,1H3,(H,21,25)
InChIKeyIZAJTASQBRSCKO-UHFFFAOYSA-N
XLogP3.07
TPSA65.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2S)-2-(1H-indol-2-yl)piperidin-1-yl]-N-(oxan-4-yl)acetamide
CID 95324295
3-[(2R)-2-(1H-indol-2-yl)piperidin-1-yl]propanoic acid
CID 124704455
3-[(2S)-2-(1H-indol-2-yl)piperidin-1-yl]-N-(methylcarbamoyl)propanamide
CID 95322772
N-[(1-ethylpyrazol-4-yl)methyl]-2-(1H-indol-2-yl)piperidine-1-carboxamide
CID 154757998
2-[(2R)-1-[(5-methylpyrazin-2-yl)methyl]piperidin-2-yl]-1H-indole
CID 95344808
[2-(1H-indol-2-yl)piperidin-1-yl]-pyrrolidin-3-ylmethanone
CID 119776657
[2-(1H-indol-2-yl)piperidin-1-yl]-(oxan-4-yl)methanone
CID 113089008
1-[2-(1H-indol-2-yl)piperidin-1-yl]-2-(2-methylphenyl)ethanone
CID 113089000
1-[(2R)-2-(1H-indol-2-yl)piperidin-1-yl]-2-(6-methyl-3-pyridinyl)ethanone
CID 95616938
2-[2-(1H-indol-2-yl)piperidin-1-yl]-4-methylpyrimidine-5-carboxylic acid
CID 154868012
2-[1-(piperidin-4-ylmethyl)piperidin-2-yl]-1H-indole;hydrochloride
CID 119931465
2-[4-(1H-indol-2-yl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51097289

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide?
The IUPAC name of 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide (CID 155961802) is 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide is Cn1cc(NC(=O)CN2CCCCC2c2cc3ccccc3[nH]2)cn1.
What is the InChIKey of 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide?
The InChIKey is IZAJTASQBRSCKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-23-12-15(11-20-23)21-19(25)13-24-9-5-4-8-18(24)17-10-14-6-2-3-7-16(14)22-17/h2-3,6-7,10-12,18,22H,4-5,8-9,13H2,1H3,(H,21,25).
What are the key properties of 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide?
2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide has a molecular weight of 337.43 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1H-indol-2-yl)piperidin-1-yl]-N-(1-methylpyrazol-4-yl)acetamide is sourced from PubChem (CID 155961802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).