3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide

C14H15N5OS — CID 80691393

IUPAC3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCn1cc(CCNC(=O)c2sc3ncccc3c2N)cn1
InChIInChI=1S/C14H15N5OS/c1-19-8-9(7-18-19)4-6-16-13(20)12-11(15)10-3-2-5-17-14(10)21-12/h2-3,5,7-8H,4,6,15H2,1H3,(H,16,20)
InChIKeyRCQFRWVMGCACLV-UHFFFAOYSA-N
MW301.38 g/mol
LogP1.58
Rot. Bonds4

About 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide

3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 80691393) has the molecular formula C14H15N5OS and a molecular weight of 301.38 g/mol. Its IUPAC name is 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID80691393
Molecular FormulaC14H15N5OS
Molecular Weight301.38 g/mol
Exact Mass301.10
IUPAC Name3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCn1cc(CCNC(=O)c2sc3ncccc3c2N)cn1
InChIInChI=1S/C14H15N5OS/c1-19-8-9(7-18-19)4-6-16-13(20)12-11(15)10-3-2-5-17-14(10)21-12/h2-3,5,7-8H,4,6,15H2,1H3,(H,16,20)
InChIKeyRCQFRWVMGCACLV-UHFFFAOYSA-N
XLogP1.58
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-[2-(carbamoylamino)ethyl]thieno[2,3-b]pyridine-2-carboxamide
CID 83117309
4-amino-2-(dimethylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 116671491
3-amino-N-(3-cyclopentylpropyl)thieno[2,3-b]pyridine-2-carboxamide
CID 106015905
N-[2-(1-methylpyrazol-4-yl)ethyl]-2-(propylamino)pyridine-3-carboxamide
CID 80691532
N-[2-(1-methylpyrazol-4-yl)ethyl]-1H-indole-3-carboxamide
CID 47381471
5-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]thieno[2,3-c]pyridazine-6-carboxamide
CID 80690837
3-amino-N-(2-bromoprop-2-enyl)thieno[2,3-b]pyridine-2-carboxamide
CID 113465232
3-amino-N-[[1-(hydroxymethyl)cyclopropyl]methyl]thieno[2,3-b]pyridine-2-carboxamide
CID 115457149
3-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,3-diamine
CID 104540597
2-amino-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-carboxamide
CID 62185127
3-amino-N-[(3-methylcyclopentyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
CID 107415732
3-amino-N-(1,2-oxazol-5-ylmethyl)thieno[2,3-b]pyridine-2-carboxamide
CID 106423442

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide (CID 80691393) is 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide is Cn1cc(CCNC(=O)c2sc3ncccc3c2N)cn1.
What is the InChIKey of 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is RCQFRWVMGCACLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c1-19-8-9(7-18-19)4-6-16-13(20)12-11(15)10-3-2-5-17-14(10)21-12/h2-3,5,7-8H,4,6,15H2,1H3,(H,16,20).
What are the key properties of 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 301.38 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 80691393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).