N-tert-butyl-2-(1H-indol-2-yl)acetamide

C14H18N2O — CID 3274953

IUPACN-tert-butyl-2-(1H-indol-2-yl)acetamide
SMILESCC(C)(C)NC(=O)Cc1cc2ccccc2[nH]1
InChIInChI=1S/C14H18N2O/c1-14(2,3)16-13(17)9-11-8-10-6-4-5-7-12(10)15-11/h4-8,15H,9H2,1-3H3,(H,16,17)
InChIKeyFOCZMLVCBNVUOM-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.63
Rot. Bonds2

About N-tert-butyl-2-(1H-indol-2-yl)acetamide

N-tert-butyl-2-(1H-indol-2-yl)acetamide (PubChem CID 3274953) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is N-tert-butyl-2-(1H-indol-2-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(1H-indol-2-yl)acetamide
PubChem CID3274953
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC NameN-tert-butyl-2-(1H-indol-2-yl)acetamide
SMILESCC(C)(C)NC(=O)Cc1cc2ccccc2[nH]1
InChIInChI=1S/C14H18N2O/c1-14(2,3)16-13(17)9-11-8-10-6-4-5-7-12(10)15-11/h4-8,15H,9H2,1-3H3,(H,16,17)
InChIKeyFOCZMLVCBNVUOM-UHFFFAOYSA-N
XLogP2.63
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butyl-2-[[N-ethyl-N'-(1H-indol-2-ylmethyl)carbamimidoyl]amino]acetamide;hydroiodide
CID 111384718
ethanol;2-(1H-indol-2-yl)acetic acid
CID 157082351
methyl 2-(1H-indol-2-ylmethyl)prop-2-enoate
CID 68733352
1H-indol-2-ylmethylcarbamic acid
CID 68691362
N-(1H-indol-2-ylmethyl)acetamide
CID 66552376
2-(1H-indol-2-yl)-N-[(5-methylfuran-2-yl)methylideneamino]acetamide
CID 3574124
4-(1H-indol-2-yl)butan-2-one
CID 10954278
5-(1H-indol-2-yl)-N-(2-methylphenyl)pentanamide
CID 11673936
(2S)-2-amino-N-(1H-indol-2-ylmethyl)-3,3-dimethylbutanamide
CID 90653128
methyl 2-[4-(1H-indol-2-ylmethyl)phenyl]acetate
CID 70109234
dimethyl 2-(1H-indol-2-ylmethyl)propanedioate
CID 132519173
1-(1H-indol-2-yl)-2-(iodoamino)-4-methylpentan-3-one
CID 176556183

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(1H-indol-2-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(1H-indol-2-yl)acetamide (CID 3274953) is N-tert-butyl-2-(1H-indol-2-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(1H-indol-2-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(1H-indol-2-yl)acetamide is CC(C)(C)NC(=O)Cc1cc2ccccc2[nH]1.
What is the InChIKey of N-tert-butyl-2-(1H-indol-2-yl)acetamide?
The InChIKey is FOCZMLVCBNVUOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-14(2,3)16-13(17)9-11-8-10-6-4-5-7-12(10)15-11/h4-8,15H,9H2,1-3H3,(H,16,17).
What are the key properties of N-tert-butyl-2-(1H-indol-2-yl)acetamide?
N-tert-butyl-2-(1H-indol-2-yl)acetamide has a molecular weight of 230.31 g/mol, XLogP of 2.63, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(1H-indol-2-yl)acetamide is sourced from PubChem (CID 3274953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).