N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide

C18H25N3O2 — CID 56825863

IUPACN-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide
SMILESCOCCn1ccc2cc(NC(=O)N3CCC(C)CC3)ccc21
InChIInChI=1S/C18H25N3O2/c1-14-5-8-21(9-6-14)18(22)19-16-3-4-17-15(13-16)7-10-20(17)11-12-23-2/h3-4,7,10,13-14H,5-6,8-9,11-12H2,1-2H3,(H,19,22)
InChIKeyYASOVIQEXPORDS-UHFFFAOYSA-N
MW315.42 g/mol
LogP3.55
Rot. Bonds4

About N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide

N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide (PubChem CID 56825863) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide
PubChem CID56825863
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide
SMILESCOCCn1ccc2cc(NC(=O)N3CCC(C)CC3)ccc21
InChIInChI=1S/C18H25N3O2/c1-14-5-8-21(9-6-14)18(22)19-16-3-4-17-15(13-16)7-10-20(17)11-12-23-2/h3-4,7,10,13-14H,5-6,8-9,11-12H2,1-2H3,(H,19,22)
InChIKeyYASOVIQEXPORDS-UHFFFAOYSA-N
XLogP3.55
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,2-N-bis[1-(2-methoxyethyl)indol-5-yl]cyclopropane-1,2-dicarboxamide
CID 167911759
4-(1-hydroxyethyl)-N-(1-propylindol-5-yl)piperidine-1-carboxamide
CID 111424917
1-[1-(2-methoxyethyl)indol-5-yl]-3-[[(2S)-oxolan-2-yl]methyl]urea
CID 95572777
1-[[(1R,2S)-2-hydroxycyclopentyl]methyl]-3-[1-(2-methoxyethyl)indol-5-yl]urea
CID 96518060
(7R)-N-[1-(2-methoxyethyl)indol-6-yl]-4,7-dimethyl-1,4-diazepane-1-carboxamide
CID 124850780
methyl N-[2-[[1-(2-methoxyethyl)indol-5-yl]amino]-2-oxoethyl]carbamate
CID 71934793
4-(hydroxymethyl)-N-[1-(2-methylpropyl)indol-5-yl]piperidine-1-carboxamide
CID 110936365
1-[1-(2-methoxyethyl)indol-5-yl]-3-prop-2-enylurea
CID 56825864
methyl 1-(2-methoxyethyl)indole-5-carboxylate
CID 67169484
N-[1-(2-methoxyethyl)indol-3-yl]-4-methylpiperidine-1-carboxamide
CID 18582430
4-(cyclopropanecarbonyl)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]piperazine-1-carboxamide
CID 56556621
N-[1-(2-methylpropyl)indol-5-yl]pyrrolidine-1-carboxamide
CID 52865791

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide (CID 56825863) is N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide is COCCn1ccc2cc(NC(=O)N3CCC(C)CC3)ccc21.
What is the InChIKey of N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide?
The InChIKey is YASOVIQEXPORDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-14-5-8-21(9-6-14)18(22)19-16-3-4-17-15(13-16)7-10-20(17)11-12-23-2/h3-4,7,10,13-14H,5-6,8-9,11-12H2,1-2H3,(H,19,22).
What are the key properties of N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide?
N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyethyl)indol-5-yl]-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 56825863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).