5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide

C19H21N5O3 — CID 142226306

IUPAC5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide
SMILESCCn1c(C(=O)Nc2ccc(NOC)cn2)cc2cc(NC(C)=O)ccc21
InChIInChI=1S/C19H21N5O3/c1-4-24-16-7-5-14(21-12(2)25)9-13(16)10-17(24)19(26)22-18-8-6-15(11-20-18)23-27-3/h5-11,23H,4H2,1-3H3,(H,21,25)(H,20,22,26)
InChIKeyUWMVRLJPKGJNJM-UHFFFAOYSA-N
MW367.41 g/mol
LogP3.24
Rot. Bonds6

About 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide

5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide (PubChem CID 142226306) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide.

Molecular Properties

Compound Name5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide
PubChem CID142226306
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC Name5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide
SMILESCCn1c(C(=O)Nc2ccc(NOC)cn2)cc2cc(NC(C)=O)ccc21
InChIInChI=1S/C19H21N5O3/c1-4-24-16-7-5-14(21-12(2)25)9-13(16)10-17(24)19(26)22-18-8-6-15(11-20-18)23-27-3/h5-11,23H,4H2,1-3H3,(H,21,25)(H,20,22,26)
InChIKeyUWMVRLJPKGJNJM-UHFFFAOYSA-N
XLogP3.24
TPSA97.28 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 53.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-chloro-1-ethyl-N-[6-(3-methoxypropylamino)-3-pyridinyl]indole-2-carboxamide
CID 67416027
1-ethyl-5-(propanoylamino)indole-2-carboxamide
CID 90488702
5-[(2-chlorobenzoyl)amino]-1-ethylindole-2-carboxamide
CID 83282724
1-ethyl-5-[(2-fluorobenzoyl)amino]indole-2-carboxamide
CID 83282725
N-(1-ethyl-2-phenylindol-5-yl)-2-methoxybenzamide
CID 24760244
tert-butyl 4-[5-[(5-chloro-1-ethylindole-2-carbonyl)amino]-2-pyridinyl]piperazine-1-carboxylate
CID 59365160
1-ethyl-5-(furan-2-carbonylamino)-N-(2-pyridin-2-ylethyl)indole-2-carboxamide
CID 83273760
1-ethyl-5-(thiophene-2-carbonylamino)indole-2-carboxamide
CID 83282723
methyl N-[5-(3-acetamidoanilino)-2-pyridinyl]carbamate
CID 113035161
5-[(2-chlorobenzoyl)amino]-1-ethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 83282703
N-(2-methoxyethyl)-5-(3-methylbutanoylamino)-1-propylindole-2-carboxamide
CID 90488214
methyl 5-acetamido-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylate;methyl 5-amino-1-[(3,4-dichlorophenyl)methyl]indole-2-carboxylate
CID 158948846

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide?
The IUPAC name of 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide (CID 142226306) is 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide.
What is the SMILES notation for 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide?
The canonical SMILES for 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide is CCn1c(C(=O)Nc2ccc(NOC)cn2)cc2cc(NC(C)=O)ccc21.
What is the InChIKey of 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide?
The InChIKey is UWMVRLJPKGJNJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-4-24-16-7-5-14(21-12(2)25)9-13(16)10-17(24)19(26)22-18-8-6-15(11-20-18)23-27-3/h5-11,23H,4H2,1-3H3,(H,21,25)(H,20,22,26).
What are the key properties of 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide?
5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide has a molecular weight of 367.41 g/mol, XLogP of 3.24, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-1-ethyl-N-[5-(methoxyamino)-2-pyridinyl]indole-2-carboxamide is sourced from PubChem (CID 142226306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).