N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide

C20H29N3O — CID 131946875

IUPACN-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide
SMILESCCn1c(C)cc2cc(NC(=O)CCC3CCCCN3C)ccc21
InChIInChI=1S/C20H29N3O/c1-4-23-15(2)13-16-14-17(8-10-19(16)23)21-20(24)11-9-18-7-5-6-12-22(18)3/h8,10,13-14,18H,4-7,9,11-12H2,1-3H3,(H,21,24)
InChIKeyQNULNJDLSOYXOP-UHFFFAOYSA-N
MW327.47 g/mol
LogP4.17
Rot. Bonds5

About N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide

N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide (PubChem CID 131946875) has the molecular formula C20H29N3O and a molecular weight of 327.47 g/mol. Its IUPAC name is N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide.

Molecular Properties

Compound NameN-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide
PubChem CID131946875
Molecular FormulaC20H29N3O
Molecular Weight327.47 g/mol
Exact Mass327.23
IUPAC NameN-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide
SMILESCCn1c(C)cc2cc(NC(=O)CCC3CCCCN3C)ccc21
InChIInChI=1S/C20H29N3O/c1-4-23-15(2)13-16-14-17(8-10-19(16)23)21-20(24)11-9-18-7-5-6-12-22(18)3/h8,10,13-14,18H,4-7,9,11-12H2,1-3H3,(H,21,24)
InChIKeyQNULNJDLSOYXOP-UHFFFAOYSA-N
XLogP4.17
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.47
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethyl-2-methylindol-5-yl)-1-methylazepane-2-carboxamide
CID 131946732
4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide
CID 16673218
3-(1-methylpiperidin-2-yl)-N-[4-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]propanamide
CID 131897537
2-[(1,1-dioxothiolan-3-yl)-methylamino]-N-(1-ethyl-2-methylindol-5-yl)acetamide
CID 131921817
N-(1-ethyl-2-methylindol-5-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 131932657
2-methyl-1-[2-[(2R)-1-methylpiperidin-2-yl]ethyl]indole
CID 92981302
N-(1-ethyl-2-methylindol-5-yl)-5-oxopyrrolidine-2-carboxamide
CID 131891608
N-(2,6-difluorophenyl)-3-(1-methylpiperidin-2-yl)propanamide
CID 110865271
2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide
CID 131907510
3-(1-methylpiperidin-2-yl)-N-(2,3,4-trifluorophenyl)propanamide
CID 110865151
N-(1-ethyl-2-methylindol-5-yl)-4,4-difluoropiperidine-1-carboxamide
CID 72862845
N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110856796

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide?
The IUPAC name of N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide (CID 131946875) is N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide.
What is the SMILES notation for N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide?
The canonical SMILES for N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide is CCn1c(C)cc2cc(NC(=O)CCC3CCCCN3C)ccc21.
What is the InChIKey of N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide?
The InChIKey is QNULNJDLSOYXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O/c1-4-23-15(2)13-16-14-17(8-10-19(16)23)21-20(24)11-9-18-7-5-6-12-22(18)3/h8,10,13-14,18H,4-7,9,11-12H2,1-3H3,(H,21,24).
What are the key properties of N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide?
N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide has a molecular weight of 327.47 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide is sourced from PubChem (CID 131946875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).