N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide

C24H27N3O2 — CID 109044889

IUPACN-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide
SMILESCC1CCN(C(=O)c2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2)CC1
InChIInChI=1S/C24H27N3O2/c1-17-11-14-27(15-12-17)24(29)19-8-6-18(7-9-19)23(28)25-13-10-20-16-26-22-5-3-2-4-21(20)22/h2-9,16-17,26H,10-15H2,1H3,(H,25,28)
InChIKeyAZRXBMHVNVYTEM-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.01
Rot. Bonds5

About N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide

N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide (PubChem CID 109044889) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide
PubChem CID109044889
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide
SMILESCC1CCN(C(=O)c2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2)CC1
InChIInChI=1S/C24H27N3O2/c1-17-11-14-27(15-12-17)24(29)19-8-6-18(7-9-19)23(28)25-13-10-20-16-26-22-5-3-2-4-21(20)22/h2-9,16-17,26H,10-15H2,1H3,(H,25,28)
InChIKeyAZRXBMHVNVYTEM-UHFFFAOYSA-N
XLogP4.01
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidin-1-yl)sulfonylbenzamide
CID 27644813
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109146249
(6S)-N-[2-(1H-indol-3-yl)ethyl]-6-methyl-1,1-dioxo-1,4-thiazepane-4-carboxamide
CID 129402017
N-[2-(1H-indol-3-yl)ethyl]-5-(4-methylpiperazine-1-carbonyl)pyridine-3-carboxamide
CID 109104428
1-N-[2-(1H-indol-3-yl)ethyl]-4-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043503
N-[2-(1H-indol-3-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27644488
4-[cyclohexyl(methyl)sulfamoyl]-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645778
(6S)-N-[2-(1H-indol-3-yl)ethyl]-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 2114335
4-(dimethylsulfamoyl)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645316
N-[2-(1H-indol-3-yl)ethyl]-4-morpholin-4-ylsulfonylbenzamide
CID 1272760
N-[2-(1H-indol-3-yl)ethyl]-2H-benzotriazole-5-carboxamide
CID 18532713

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide (CID 109044889) is N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide is CC1CCN(C(=O)c2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2)CC1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
The InChIKey is AZRXBMHVNVYTEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-17-11-14-27(15-12-17)24(29)19-8-6-18(7-9-19)23(28)25-13-10-20-16-26-22-5-3-2-4-21(20)22/h2-9,16-17,26H,10-15H2,1H3,(H,25,28).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide?
N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide has a molecular weight of 389.50 g/mol, XLogP of 4.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]-4-(4-methylpiperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109044889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).