N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide

C17H22N2O2 — CID 95748634

IUPACN-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide
SMILESCN(CC1CC1)C(=O)CN1C(=O)C(C)(C)c2ccccc21
InChIInChI=1S/C17H22N2O2/c1-17(2)13-6-4-5-7-14(13)19(16(17)21)11-15(20)18(3)10-12-8-9-12/h4-7,12H,8-11H2,1-3H3
InChIKeyUXOVJZKWAGZEFM-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.18
Rot. Bonds4

About N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide

N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide (PubChem CID 95748634) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide
PubChem CID95748634
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC NameN-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide
SMILESCN(CC1CC1)C(=O)CN1C(=O)C(C)(C)c2ccccc21
InChIInChI=1S/C17H22N2O2/c1-17(2)13-6-4-5-7-14(13)19(16(17)21)11-15(20)18(3)10-12-8-9-12/h4-7,12H,8-11H2,1-3H3
InChIKeyUXOVJZKWAGZEFM-UHFFFAOYSA-N
XLogP2.18
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide (CID 95748634) is N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide is CN(CC1CC1)C(=O)CN1C(=O)C(C)(C)c2ccccc21.
What is the InChIKey of N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide?
The InChIKey is UXOVJZKWAGZEFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-17(2)13-6-4-5-7-14(13)19(16(17)21)11-15(20)18(3)10-12-8-9-12/h4-7,12H,8-11H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide?
N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide has a molecular weight of 286.37 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(3,3-dimethyl-2-oxoindol-1-yl)-N-methylacetamide is sourced from PubChem (CID 95748634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).