N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide

C20H23N3O2 — CID 97132449

IUPACN-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide
SMILESCOC[C@@H](c1ccccn1)N(C)C(=O)c1[nH]c2ccc(C)cc2c1C
InChIInChI=1S/C20H23N3O2/c1-13-8-9-16-15(11-13)14(2)19(22-16)20(24)23(3)18(12-25-4)17-7-5-6-10-21-17/h5-11,18,22H,12H2,1-4H3/t18-/m0/s1
InChIKeySRZCHWLQBAXYDI-SFHVURJKSA-N
MW337.42 g/mol
LogP3.64
Rot. Bonds5

About N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide

N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide (PubChem CID 97132449) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide
PubChem CID97132449
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide
SMILESCOC[C@@H](c1ccccn1)N(C)C(=O)c1[nH]c2ccc(C)cc2c1C
InChIInChI=1S/C20H23N3O2/c1-13-8-9-16-15(11-13)14(2)19(22-16)20(24)23(3)18(12-25-4)17-7-5-6-10-21-17/h5-11,18,22H,12H2,1-4H3/t18-/m0/s1
InChIKeySRZCHWLQBAXYDI-SFHVURJKSA-N
XLogP3.64
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

4-(2,5-dimethylphenyl)-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methylbenzamide
CID 119066040
6-fluoro-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-4-oxo-1H-quinoline-3-carboxamide
CID 74242682
N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 70760488
N-[(1S)-2-methoxy-1-pyridin-2-ylethyl]-N,4-dimethyl-2-propan-2-yl-1,3-thiazole-5-carboxamide
CID 97146350
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N-methyl-2-phenylpyrimidine-5-carboxamide
CID 95123486
4-chloro-N-(2-methoxy-1-pyridin-2-ylethyl)-N,1-dimethylpyrazole-3-carboxamide
CID 131933604
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N-methyl-1-benzothiophene-5-carboxamide
CID 97152757
5-ethoxy-N,3-dimethyl-N-[(2R)-1-pyridin-2-ylpropan-2-yl]-1H-indole-2-carboxamide
CID 51500846
3-(5,6-dimethyl-2-pyridinyl)-N-[(1S)-2-methoxy-1-pyridin-2-ylethyl]-N-methylbenzamide
CID 125439779
N-[(2-ethoxyphenyl)methyl]-N,3,5-trimethyl-1H-indole-2-carboxamide
CID 70731482
4-[3-(hydroxymethyl)phenyl]-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methylnaphthalene-1-carboxamide
CID 172662620
1-ethyl-N-(2-methoxy-1-pyridin-2-ylethyl)-N-methyl-3-(2-methylpropyl)pyrazole-5-carboxamide
CID 77092549

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide?
The IUPAC name of N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide (CID 97132449) is N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide?
The canonical SMILES for N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide is COC[C@@H](c1ccccn1)N(C)C(=O)c1[nH]c2ccc(C)cc2c1C.
What is the InChIKey of N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide?
The InChIKey is SRZCHWLQBAXYDI-SFHVURJKSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-13-8-9-16-15(11-13)14(2)19(22-16)20(24)23(3)18(12-25-4)17-7-5-6-10-21-17/h5-11,18,22H,12H2,1-4H3/t18-/m0/s1.
What are the key properties of N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide?
N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-methoxy-1-pyridin-2-ylethyl]-N,3,5-trimethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 97132449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).