5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide

C15H14N4O — CID 79041889

IUPAC5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide
SMILESCc1ncccc1NC(=O)c1cc2cc(N)ccc2[nH]1
InChIInChI=1S/C15H14N4O/c1-9-12(3-2-6-17-9)19-15(20)14-8-10-7-11(16)4-5-13(10)18-14/h2-8,18H,16H2,1H3,(H,19,20)
InChIKeyKEECRTHODFBIDM-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.71
Rot. Bonds2

About 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide

5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide (PubChem CID 79041889) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide
PubChem CID79041889
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide
SMILESCc1ncccc1NC(=O)c1cc2cc(N)ccc2[nH]1
InChIInChI=1S/C15H14N4O/c1-9-12(3-2-6-17-9)19-15(20)14-8-10-7-11(16)4-5-13(10)18-14/h2-8,18H,16H2,1H3,(H,19,20)
InChIKeyKEECRTHODFBIDM-UHFFFAOYSA-N
XLogP2.71
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-(2-methyl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 79042031
5-amino-N-(2,3-difluorophenyl)-1H-indole-2-carboxamide
CID 63118402
5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-indole-2-carboxamide
CID 63117740
5-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)-1H-indole-2-carboxamide
CID 65486031
5-amino-N-methyl-1H-indole-2-carboxamide
CID 63117746
5-amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-indole-2-carboxamide
CID 115597844
6-amino-N-(2-methyl-3-pyridinyl)-1H-indole-3-carboxamide
CID 79041592
3,5-diamino-N-(2-methyl-3-pyridinyl)benzamide
CID 79042253
5-amino-N-(2-chloropyrimidin-4-yl)-1H-indole-2-carboxamide
CID 116794626
5-amino-N-(1-pyridin-2-ylethyl)-1H-indole-2-carboxamide
CID 63117840
5-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 79735742
5-amino-N-(4-iodophenyl)-1H-indole-2-carboxamide
CID 62057441

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide?
The IUPAC name of 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide (CID 79041889) is 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide.
What is the SMILES notation for 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide?
The canonical SMILES for 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide is Cc1ncccc1NC(=O)c1cc2cc(N)ccc2[nH]1.
What is the InChIKey of 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide?
The InChIKey is KEECRTHODFBIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-9-12(3-2-6-17-9)19-15(20)14-8-10-7-11(16)4-5-13(10)18-14/h2-8,18H,16H2,1H3,(H,19,20).
What are the key properties of 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide?
5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 2.71, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 79041889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).