N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide

C19H22N4O2S — CID 158455560

IUPACN-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1sccc1Cc1ccnc2[nH]ccc12
InChIInChI=1S/C19H22N4O2S/c24-19(22-6-7-23-8-10-25-11-9-23)17-15(3-12-26-17)13-14-1-4-20-18-16(14)2-5-21-18/h1-5,12H,6-11,13H2,(H,20,21)(H,22,24)
InChIKeyHENHSDMIEKPVMN-UHFFFAOYSA-N
MW370.48 g/mol
LogP2.28
Rot. Bonds6

About N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide

N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide (PubChem CID 158455560) has the molecular formula C19H22N4O2S and a molecular weight of 370.48 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide
PubChem CID158455560
Molecular FormulaC19H22N4O2S
Molecular Weight370.48 g/mol
Exact Mass370.15
IUPAC NameN-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1sccc1Cc1ccnc2[nH]ccc12
InChIInChI=1S/C19H22N4O2S/c24-19(22-6-7-23-8-10-25-11-9-23)17-15(3-12-26-17)13-14-1-4-20-18-16(14)2-5-21-18/h1-5,12H,6-11,13H2,(H,20,21)(H,22,24)
InChIKeyHENHSDMIEKPVMN-UHFFFAOYSA-N
XLogP2.28
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.48
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide with MolForge

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Related Compounds

N-[2-(2-morpholin-4-ylethylcarbamoyl)thiophen-3-yl]pyrazine-2-carboxamide
CID 53335963
N-(2-morpholin-4-ylethyl)-2-thiophen-2-ylpyridine-4-carboxamide
CID 53119696
4-amino-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 62156261
2-(2-fluoro-4-methylphenyl)-N-(2-morpholin-4-ylethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrrole-3-carboxamide
CID 165391729
4-N-cyclopropyl-2-N-(2-morpholin-4-ylethyl)pyridine-2,4-dicarboxamide
CID 109078417
N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 977791
4-(dipropylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207495
4-(cycloheptylamino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109207488
4-methyl-N-(2-morpholin-4-ylethyl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 39084285
3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 71690241
4-methyl-N-(2-morpholin-4-ylethyl)thieno[3,2-b]pyrrole-5-carboxamide
CID 3242210
2-methoxy-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 84580344

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide (CID 158455560) is N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide is O=C(NCCN1CCOCC1)c1sccc1Cc1ccnc2[nH]ccc12.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide?
The InChIKey is HENHSDMIEKPVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2S/c24-19(22-6-7-23-8-10-25-11-9-23)17-15(3-12-26-17)13-14-1-4-20-18-16(14)2-5-21-18/h1-5,12H,6-11,13H2,(H,20,21)(H,22,24).
What are the key properties of N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide?
N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide has a molecular weight of 370.48 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-3-(1H-pyrrolo[2,3-b]pyridin-4-ylmethyl)thiophene-2-carboxamide is sourced from PubChem (CID 158455560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).