3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide

C19H24N2O2 — CID 11507880

IUPAC3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide
SMILESCC1(C)C(C(=O)c2cn(CCC(N)=O)c3ccccc23)C1(C)C
InChIInChI=1S/C19H24N2O2/c1-18(2)17(19(18,3)4)16(23)13-11-21(10-9-15(20)22)14-8-6-5-7-12(13)14/h5-8,11,17H,9-10H2,1-4H3,(H2,20,22)
InChIKeyPAWWZSJHBLZQQT-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.38
Rot. Bonds5

About 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide

3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide (PubChem CID 11507880) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide.

Molecular Properties

Compound Name3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide
PubChem CID11507880
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide
SMILESCC1(C)C(C(=O)c2cn(CCC(N)=O)c3ccccc23)C1(C)C
InChIInChI=1S/C19H24N2O2/c1-18(2)17(19(18,3)4)16(23)13-11-21(10-9-15(20)22)14-8-6-5-7-12(13)14/h5-8,11,17H,9-10H2,1-4H3,(H2,20,22)
InChIKeyPAWWZSJHBLZQQT-UHFFFAOYSA-N
XLogP3.38
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

CID 10382701
CID 10382701
CID 10471670
CID 10471670
CID 44466638
CID 44466638
CID 57501498
CID 57501498
CID 11584525
CID 11584525
CID 45270396
CID 45270396
CID 44626619
CID 44626619
CID 9889172
CID 9889172
CID 398554
CID 398554
CID 10226340
CID 10226340
CID 11544639
CID 11544639
CID 129597835
CID 129597835

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide?
The IUPAC name of 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide (CID 11507880) is 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide.
What is the SMILES notation for 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide?
The canonical SMILES for 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide is CC1(C)C(C(=O)c2cn(CCC(N)=O)c3ccccc23)C1(C)C.
What is the InChIKey of 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide?
The InChIKey is PAWWZSJHBLZQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-18(2)17(19(18,3)4)16(23)13-11-21(10-9-15(20)22)14-8-6-5-7-12(13)14/h5-8,11,17H,9-10H2,1-4H3,(H2,20,22).
What are the key properties of 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide?
3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2,2,3,3-tetramethylcyclopropanecarbonyl)indol-1-yl]propanamide is sourced from PubChem (CID 11507880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).