N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide

C17H24N2O2 — CID 79380294

IUPACN-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide
SMILESCCN(CC(C)(C)O)C(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C17H24N2O2/c1-4-19(12-17(2,3)21)16(20)10-9-13-11-18-15-8-6-5-7-14(13)15/h5-8,11,18,21H,4,9-10,12H2,1-3H3
InChIKeyALDMQILSZSQXBP-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.72
Rot. Bonds6

About N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide

N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide (PubChem CID 79380294) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide
PubChem CID79380294
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide
SMILESCCN(CC(C)(C)O)C(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C17H24N2O2/c1-4-19(12-17(2,3)21)16(20)10-9-13-11-18-15-8-6-5-7-14(13)15/h5-8,11,18,21H,4,9-10,12H2,1-3H3
InChIKeyALDMQILSZSQXBP-UHFFFAOYSA-N
XLogP2.72
TPSA56.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-4-(1H-indol-3-yl)-N-methylbutanamide
CID 79270948
3-(2-bromophenyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)propanamide
CID 111596500
1-(1H-indol-3-yl)hexan-3-one
CID 166814803
N-carbamoyl-3-(1H-indol-3-yl)-N-methylpropanamide
CID 123961243
N,N-diethyl-3-(1H-indol-3-ylmethylamino)propanamide
CID 60961087
3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide
CID 42951930
methyl 5-[ethyl-[2-(1H-indol-3-yl)ethyl]amino]-5-oxopentanoate
CID 23336475
N-ethyl-3-(1H-indol-3-yl)-N-[2-(2-methoxyanilino)-2-oxoethyl]propanamide
CID 26355956
N-(2-hydroxyethyl)-3-(1H-indol-3-yl)-N-methylpropanamide
CID 60652678
3-[acetyl-[2-(1H-indol-3-yl)ethyl]amino]-N-benzyl-N-ethylpropanamide
CID 113121765
1-(1H-indol-3-yl)-4-methylpentan-3-one
CID 154964513
N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide
CID 51093208

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide (CID 79380294) is N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide is CCN(CC(C)(C)O)C(=O)CCc1c[nH]c2ccccc12.
What is the InChIKey of N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide?
The InChIKey is ALDMQILSZSQXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-4-19(12-17(2,3)21)16(20)10-9-13-11-18-15-8-6-5-7-14(13)15/h5-8,11,18,21H,4,9-10,12H2,1-3H3.
What are the key properties of N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide?
N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide has a molecular weight of 288.39 g/mol, XLogP of 2.72, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 79380294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).