N-cyclopropyl-3-(7-formylindol-1-yl)propanamide

C15H16N2O2 — CID 102909918

IUPACN-cyclopropyl-3-(7-formylindol-1-yl)propanamide
SMILESO=Cc1cccc2ccn(CCC(=O)NC3CC3)c12
InChIInChI=1S/C15H16N2O2/c18-10-12-3-1-2-11-6-8-17(15(11)12)9-7-14(19)16-13-4-5-13/h1-3,6,8,10,13H,4-5,7,9H2,(H,16,19)
InChIKeyVMRHQQFXDNVJFE-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.12
Rot. Bonds5

About N-cyclopropyl-3-(7-formylindol-1-yl)propanamide

N-cyclopropyl-3-(7-formylindol-1-yl)propanamide (PubChem CID 102909918) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-cyclopropyl-3-(7-formylindol-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(7-formylindol-1-yl)propanamide
PubChem CID102909918
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-cyclopropyl-3-(7-formylindol-1-yl)propanamide
SMILESO=Cc1cccc2ccn(CCC(=O)NC3CC3)c12
InChIInChI=1S/C15H16N2O2/c18-10-12-3-1-2-11-6-8-17(15(11)12)9-7-14(19)16-13-4-5-13/h1-3,6,8,10,13H,4-5,7,9H2,(H,16,19)
InChIKeyVMRHQQFXDNVJFE-UHFFFAOYSA-N
XLogP2.12
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-3-(7-nitroindol-1-yl)propanamide
CID 114936168
1-(3,3,3-trifluoropropyl)indole-7-carbaldehyde
CID 102910127
3-[7-[(cyclopropylamino)methyl]indol-1-yl]-N-ethylpropanamide
CID 102914922
N-cyclopropyl-N-ethyl-2-(7-formylindol-1-yl)acetamide
CID 102910057
N-cyclopropyl-3-[6-(hydroxymethyl)indol-1-yl]propanamide
CID 102913058
1-[2-(azepan-1-yl)-2-oxoethyl]indole-7-carbaldehyde
CID 102910109
N-cyclopropyl-3-(5-methoxyindol-1-yl)propanamide
CID 116619419
N-cyclopropyl-2-[7-(propylaminomethyl)indol-1-yl]acetamide
CID 102914268
1-[3-(cyclopropylamino)-3-oxopropyl]-2-oxopyridine-3-carboxylic acid
CID 55098640
1-(2-ethylbutyl)indole-7-carbaldehyde
CID 102910011
1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]indole-7-carbaldehyde
CID 102909905
N-cyclopentyl-3-(2,4-dioxopyrimidin-1-yl)propanamide
CID 108788640

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(7-formylindol-1-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(7-formylindol-1-yl)propanamide (CID 102909918) is N-cyclopropyl-3-(7-formylindol-1-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(7-formylindol-1-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(7-formylindol-1-yl)propanamide is O=Cc1cccc2ccn(CCC(=O)NC3CC3)c12.
What is the InChIKey of N-cyclopropyl-3-(7-formylindol-1-yl)propanamide?
The InChIKey is VMRHQQFXDNVJFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c18-10-12-3-1-2-11-6-8-17(15(11)12)9-7-14(19)16-13-4-5-13/h1-3,6,8,10,13H,4-5,7,9H2,(H,16,19).
What are the key properties of N-cyclopropyl-3-(7-formylindol-1-yl)propanamide?
N-cyclopropyl-3-(7-formylindol-1-yl)propanamide has a molecular weight of 256.31 g/mol, XLogP of 2.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(7-formylindol-1-yl)propanamide is sourced from PubChem (CID 102909918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).