5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide

C12H14BrN5O — CID 62174779

IUPAC5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCCNc1ncc(Br)cc1C(=O)Nc1ccnn1C
InChIInChI=1S/C12H14BrN5O/c1-3-14-11-9(6-8(13)7-15-11)12(19)17-10-4-5-16-18(10)2/h4-7H,3H2,1-2H3,(H,14,15)(H,17,19)
InChIKeyKIAKPXNVAAAIFK-UHFFFAOYSA-N
MW324.18 g/mol
LogP2.26
Rot. Bonds4

About 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide

5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide (PubChem CID 62174779) has the molecular formula C12H14BrN5O and a molecular weight of 324.18 g/mol. Its IUPAC name is 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
PubChem CID62174779
Molecular FormulaC12H14BrN5O
Molecular Weight324.18 g/mol
Exact Mass323.04
IUPAC Name5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCCNc1ncc(Br)cc1C(=O)Nc1ccnn1C
InChIInChI=1S/C12H14BrN5O/c1-3-14-11-9(6-8(13)7-15-11)12(19)17-10-4-5-16-18(10)2/h4-7H,3H2,1-2H3,(H,14,15)(H,17,19)
InChIKeyKIAKPXNVAAAIFK-UHFFFAOYSA-N
XLogP2.26
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.18
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-2-(ethylamino)-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-carboxamide
CID 62184957
2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 55209117
5-chloro-6-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 62176197
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-(ethylamino)pyridine-3-carboxamide
CID 83169522
5-bromo-2-(ethylamino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 62167609
5-bromo-2-(ethylamino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 62166744
5-bromo-N-(2-chloro-5-fluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 107531221
5-bromo-N-(4-chloro-3-fluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 63501333
5-bromo-N-(3-chloro-2-methylphenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62186772
5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62165850
methyl 5-bromo-2-(ethylamino)pyridine-3-carboxylate
CID 130830671
5-bromo-N-(5-bromo-2-pyridinyl)-2-(propylamino)pyridine-3-carboxamide
CID 62165422

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide (CID 62174779) is 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide is CCNc1ncc(Br)cc1C(=O)Nc1ccnn1C.
What is the InChIKey of 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
The InChIKey is KIAKPXNVAAAIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrN5O/c1-3-14-11-9(6-8(13)7-15-11)12(19)17-10-4-5-16-18(10)2/h4-7H,3H2,1-2H3,(H,14,15)(H,17,19).
What are the key properties of 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide?
5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide has a molecular weight of 324.18 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 62174779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).