2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide

C16H22N2O2 — CID 82960282

IUPAC2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide
SMILESCOCCN(C(=O)Cc1c[nH]c2ccccc12)C(C)C
InChIInChI=1S/C16H22N2O2/c1-12(2)18(8-9-20-3)16(19)10-13-11-17-15-7-5-4-6-14(13)15/h4-7,11-12,17H,8-10H2,1-3H3
InChIKeyPQRPOEQGQIZAPD-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.59
Rot. Bonds6

About 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide

2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide (PubChem CID 82960282) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide
PubChem CID82960282
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide
SMILESCOCCN(C(=O)Cc1c[nH]c2ccccc12)C(C)C
InChIInChI=1S/C16H22N2O2/c1-12(2)18(8-9-20-3)16(19)10-13-11-17-15-7-5-4-6-14(13)15/h4-7,11-12,17H,8-10H2,1-3H3
InChIKeyPQRPOEQGQIZAPD-UHFFFAOYSA-N
XLogP2.59
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-indol-3-yl)-N-propan-2-yl-N-propylacetamide
CID 43583126
2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-prop-2-enylacetamide
CID 103339966
N-[3-[acetyl(propan-2-yl)amino]propyl]-2-(1H-indol-3-yl)acetamide
CID 47042094
N-(1,3-benzothiazol-2-yl)-2-(1H-indol-3-yl)-N-(2-methoxyethyl)acetamide
CID 34261879
2-(1H-indol-3-yl)-N-[1-(2-methoxyphenyl)ethyl]-N-methylacetamide
CID 46591974
2-(1H-indol-3-yl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)acetamide
CID 112692080
N-(2-amino-2-oxoethyl)-3-(1H-indol-3-yl)-N-propan-2-ylpropanamide
CID 43397899
N-[2-(1H-indol-3-yl)ethyl]-2-[(2-methoxyacetyl)-propan-2-ylamino]-N-[(4-methylphenyl)methyl]acetamide
CID 4581832
N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
2-[[2-(1H-indol-3-yl)acetyl]-methylamino]acetic acid
CID 24707532
3-methoxypropyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate
CID 104911563
N-[2-(1H-indol-3-yl)ethyl]-2-[(2-methoxyacetyl)-propan-2-ylamino]-N-[(4-methoxyphenyl)methyl]acetamide
CID 42770548

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide (CID 82960282) is 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide is COCCN(C(=O)Cc1c[nH]c2ccccc12)C(C)C.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide?
The InChIKey is PQRPOEQGQIZAPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12(2)18(8-9-20-3)16(19)10-13-11-17-15-7-5-4-6-14(13)15/h4-7,11-12,17H,8-10H2,1-3H3.
What are the key properties of 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide?
2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide has a molecular weight of 274.36 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(2-methoxyethyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 82960282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).