N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide

C17H24N2O2 — CID 11507534

IUPACN-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide
SMILESCCC(=O)NCC(C)(C)c1cn(C)c2ccc(OC)cc12
InChIInChI=1S/C17H24N2O2/c1-6-16(20)18-11-17(2,3)14-10-19(4)15-8-7-12(21-5)9-13(14)15/h7-10H,6,11H2,1-5H3,(H,18,20)
InChIKeyQBJWGJIESUDHDM-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.99
Rot. Bonds5

About N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide

N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide (PubChem CID 11507534) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide.

Molecular Properties

Compound NameN-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide
PubChem CID11507534
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide
SMILESCCC(=O)NCC(C)(C)c1cn(C)c2ccc(OC)cc12
InChIInChI=1S/C17H24N2O2/c1-6-16(20)18-11-17(2,3)14-10-19(4)15-8-7-12(21-5)9-13(14)15/h7-10H,6,11H2,1-5H3,(H,18,20)
InChIKeyQBJWGJIESUDHDM-UHFFFAOYSA-N
XLogP2.99
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide?
The IUPAC name of N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide (CID 11507534) is N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide.
What is the SMILES notation for N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide?
The canonical SMILES for N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide is CCC(=O)NCC(C)(C)c1cn(C)c2ccc(OC)cc12.
What is the InChIKey of N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide?
The InChIKey is QBJWGJIESUDHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-6-16(20)18-11-17(2,3)14-10-19(4)15-8-7-12(21-5)9-13(14)15/h7-10H,6,11H2,1-5H3,(H,18,20).
What are the key properties of N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide?
N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide has a molecular weight of 288.39 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide is sourced from PubChem (CID 11507534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).