2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide

C20H27N3O2 — CID 30855548

IUPAC2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
SMILESCc1cc2ccccc2n1CC(=O)NC1CCN(C(=O)C(C)C)CC1
InChIInChI=1S/C20H27N3O2/c1-14(2)20(25)22-10-8-17(9-11-22)21-19(24)13-23-15(3)12-16-6-4-5-7-18(16)23/h4-7,12,14,17H,8-11,13H2,1-3H3,(H,21,24)
InChIKeyQVCJLTHDENCRAP-UHFFFAOYSA-N
MW341.45 g/mol
LogP2.71
Rot. Bonds4

About 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide

2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide (PubChem CID 30855548) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
PubChem CID30855548
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC Name2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
SMILESCc1cc2ccccc2n1CC(=O)NC1CCN(C(=O)C(C)C)CC1
InChIInChI=1S/C20H27N3O2/c1-14(2)20(25)22-10-8-17(9-11-22)21-19(24)13-23-15(3)12-16-6-4-5-7-18(16)23/h4-7,12,14,17H,8-11,13H2,1-3H3,(H,21,24)
InChIKeyQVCJLTHDENCRAP-UHFFFAOYSA-N
XLogP2.71
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]acetamide
CID 46418927
2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide
CID 62491076
2-(2-methylindol-1-yl)-N-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]acetamide
CID 55946647
N-(2-methylcyclohexyl)-2-(2-methylindol-1-yl)acetamide
CID 5086759
N-[(1S,2R)-2-methylcyclohexyl]-2-(2-methylindol-1-yl)acetamide
CID 40655877
3-methyl-1-(2-methylindol-1-yl)butan-2-one
CID 12795650
N-cycloheptyl-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
CID 110680359
N-[(1R,2S,3S)-2,3-dimethylcyclohexyl]-2-(2-methylindol-1-yl)acetamide
CID 11897735
N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-2-(2-methylindol-1-yl)acetamide
CID 7328535
2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
CID 32541358
2-(3-chloro-2-oxoquinolin-1-yl)-N-cyclopropylacetamide
CID 122155041
2-(2-methylindol-1-yl)-N-[(2R)-2-(4-methylpiperazin-1-yl)propyl]acetamide
CID 95604349

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide (CID 30855548) is 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide is Cc1cc2ccccc2n1CC(=O)NC1CCN(C(=O)C(C)C)CC1.
What is the InChIKey of 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
The InChIKey is QVCJLTHDENCRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c1-14(2)20(25)22-10-8-17(9-11-22)21-19(24)13-23-15(3)12-16-6-4-5-7-18(16)23/h4-7,12,14,17H,8-11,13H2,1-3H3,(H,21,24).
What are the key properties of 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide?
2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide has a molecular weight of 341.45 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylindol-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 30855548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).