5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide

C18H23N5O3 — CID 97122642

IUPAC5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide
SMILESCOCCn1cnnc1[C@@H](C)NC(=O)c1cc2cc(OC)ccc2n1C
InChIInChI=1S/C18H23N5O3/c1-12(17-21-19-11-23(17)7-8-25-3)20-18(24)16-10-13-9-14(26-4)5-6-15(13)22(16)2/h5-6,9-12H,7-8H2,1-4H3,(H,20,24)/t12-/m1/s1
InChIKeyMPXUAZWERGUTQX-GFCCVEGCSA-N
MW357.41 g/mol
LogP1.92
Rot. Bonds7

About 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide

5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide (PubChem CID 97122642) has the molecular formula C18H23N5O3 and a molecular weight of 357.41 g/mol. Its IUPAC name is 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide
PubChem CID97122642
Molecular FormulaC18H23N5O3
Molecular Weight357.41 g/mol
Exact Mass357.18
IUPAC Name5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide
SMILESCOCCn1cnnc1[C@@H](C)NC(=O)c1cc2cc(OC)ccc2n1C
InChIInChI=1S/C18H23N5O3/c1-12(17-21-19-11-23(17)7-8-25-3)20-18(24)16-10-13-9-14(26-4)5-6-15(13)22(16)2/h5-6,9-12H,7-8H2,1-4H3,(H,20,24)/t12-/m1/s1
InChIKeyMPXUAZWERGUTQX-GFCCVEGCSA-N
XLogP1.92
TPSA83.20 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-aminopropan-2-yl)-5-methoxy-1-methylindole-2-carboxamide
CID 110833437
(2S)-2-[(5-methoxy-1-methylindole-2-carbonyl)amino]-3-methylbutanoate
CID 7070170
2-chloro-4-fluoro-N-[1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]benzamide
CID 91770169
N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methyl-2-oxopyridine-3-carboxamide
CID 126443313
N-[(1S)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methyl-2-oxopyridine-3-carboxamide
CID 126443312
6-amino-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]pyridine-3-carboxamide
CID 125170254
N-[(1S)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-4-sulfamoylbenzamide
CID 99958080
N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-2-propyl-1,3-thiazole-4-carboxamide
CID 97118047
1-(difluoromethyl)-N-[1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-5-methylpyrazole-3-carboxamide
CID 156584689
N-[(1S)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-2-methyl-5-(trifluoromethyl)benzamide
CID 125165323
N-[1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 70767304
3-(4-hydroxyphenyl)-N-[(1S)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]propanamide
CID 125177563

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide?
The IUPAC name of 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide (CID 97122642) is 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide.
What is the SMILES notation for 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide?
The canonical SMILES for 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide is COCCn1cnnc1[C@@H](C)NC(=O)c1cc2cc(OC)ccc2n1C.
What is the InChIKey of 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide?
The InChIKey is MPXUAZWERGUTQX-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H23N5O3/c1-12(17-21-19-11-23(17)7-8-25-3)20-18(24)16-10-13-9-14(26-4)5-6-15(13)22(16)2/h5-6,9-12H,7-8H2,1-4H3,(H,20,24)/t12-/m1/s1.
What are the key properties of 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide?
5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 1.92, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-[(1R)-1-[4-(2-methoxyethyl)-1,2,4-triazol-3-yl]ethyl]-1-methylindole-2-carboxamide is sourced from PubChem (CID 97122642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).