N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide

C21H29N3O — CID 51093208

IUPACN-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide
SMILESCCN1CCC(N(C(=O)CCc2c[nH]c3ccccc23)C2CC2)CC1
InChIInChI=1S/C21H29N3O/c1-2-23-13-11-18(12-14-23)24(17-8-9-17)21(25)10-7-16-15-22-20-6-4-3-5-19(16)20/h3-6,15,17-18,22H,2,7-14H2,1H3
InChIKeyRPMFNROFBHDNLN-UHFFFAOYSA-N
MW339.48 g/mol
LogP3.58
Rot. Bonds6

About N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide

N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide (PubChem CID 51093208) has the molecular formula C21H29N3O and a molecular weight of 339.48 g/mol. Its IUPAC name is N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide
PubChem CID51093208
Molecular FormulaC21H29N3O
Molecular Weight339.48 g/mol
Exact Mass339.23
IUPAC NameN-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide
SMILESCCN1CCC(N(C(=O)CCc2c[nH]c3ccccc23)C2CC2)CC1
InChIInChI=1S/C21H29N3O/c1-2-23-13-11-18(12-14-23)24(17-8-9-17)21(25)10-7-16-15-22-20-6-4-3-5-19(16)20/h3-6,15,17-18,22H,2,7-14H2,1H3
InChIKeyRPMFNROFBHDNLN-UHFFFAOYSA-N
XLogP3.58
TPSA39.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.48
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-[(3S)-2,5-dioxopyrrolidin-3-yl]-3-(1H-indol-3-yl)propanamide
CID 98471543
N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
CID 26378402
N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide
CID 79380294
N-cyclopropyl-2-(1H-indol-3-yl)-N-methylacetamide
CID 43421962
(2R)-N,N-diethyl-1-[3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxamide
CID 95196011
1-(1H-indol-3-yl)hexan-3-one
CID 166814803
N-carbamoyl-3-(1H-indol-3-yl)-N-methylpropanamide
CID 123961243
3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide
CID 42951930
(2S)-2-amino-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide;dihydrochloride
CID 119957877
N-(2-hydroxyethyl)-3-(1H-indol-3-yl)-N-methylpropanamide
CID 60652678
1-[4-(4-ethylpiperazine-1-carbonyl)piperidin-1-yl]-2-(1H-indol-3-yl)ethanone
CID 113003701
1-(3-hydroxy-4-methylpiperidin-1-yl)-3-(1H-indol-3-yl)propan-1-one
CID 103900607

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide (CID 51093208) is N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide is CCN1CCC(N(C(=O)CCc2c[nH]c3ccccc23)C2CC2)CC1.
What is the InChIKey of N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide?
The InChIKey is RPMFNROFBHDNLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O/c1-2-23-13-11-18(12-14-23)24(17-8-9-17)21(25)10-7-16-15-22-20-6-4-3-5-19(16)20/h3-6,15,17-18,22H,2,7-14H2,1H3.
What are the key properties of N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide?
N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide has a molecular weight of 339.48 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 51093208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).