N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide

C19H20FN5O — CID 177028729

IUPACN-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide
SMILESCCn1cc(-c2cc(C)nc(C3(F)CC3)n2)c2cc(NC(C)=O)ncc21
InChIInChI=1S/C19H20FN5O/c1-4-25-10-14(13-8-17(23-12(3)26)21-9-16(13)25)15-7-11(2)22-18(24-15)19(20)5-6-19/h7-10H,4-6H2,1-3H3,(H,21,23,26)
InChIKeyJDRWOJLISJKXLG-UHFFFAOYSA-N
MW353.40 g/mol
LogP3.74
Rot. Bonds4

About N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide

N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide (PubChem CID 177028729) has the molecular formula C19H20FN5O and a molecular weight of 353.40 g/mol. Its IUPAC name is N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide.

Molecular Properties

Compound NameN-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide
PubChem CID177028729
Molecular FormulaC19H20FN5O
Molecular Weight353.40 g/mol
Exact Mass353.17
IUPAC NameN-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide
SMILESCCn1cc(-c2cc(C)nc(C3(F)CC3)n2)c2cc(NC(C)=O)ncc21
InChIInChI=1S/C19H20FN5O/c1-4-25-10-14(13-8-17(23-12(3)26)21-9-16(13)25)15-7-11(2)22-18(24-15)19(20)5-6-19/h7-10H,4-6H2,1-3H3,(H,21,23,26)
InChIKeyJDRWOJLISJKXLG-UHFFFAOYSA-N
XLogP3.74
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[6-(cyclopropylamino)-2-(1,1-difluoroethyl)pyrimidin-4-yl]-1-ethylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177028739
N-[3-[2-(1,1-difluoroethyl)-6-methylpyrimidin-4-yl]-1-spiro[2.3]hexan-5-ylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177028829
N-[3-[2-(1,1-difluoroethyl)-6-methylpyrimidin-4-yl]-1-(1-methylpyrrolidin-3-yl)pyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177028706
N-[3-[2-(1,1-difluoroethyl)-6-methylpyrimidin-4-yl]-1-(2-methoxyspiro[3.3]heptan-6-yl)pyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177028792
N-[1-ethyl-3-[6-oxo-5-(3-propan-2-yloxyazetidin-1-yl)-1-[(2S)-1,1,1-trifluoropropan-2-yl]pyridazin-3-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177149786
N-[3-[2-(1,1-difluoroethyl)pyrimidin-4-yl]-1-methylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177028709
N-[3-[6-[(3R)-3-methoxyoxolan-3-yl]-4-propoxy-2-pyridinyl]-1-methylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 139482485
5-acetamido-3-(4-cyclopropyl-6-methylsulfanyl-2-pyridinyl)pyrrolo[2,3-c]pyridine-1-carboxylic acid
CID 175507451
N-[3-[2-(1,1-difluoroethyl)-6-(oxetan-3-yloxy)pyrimidin-4-yl]-1-methylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 177028839
N-[3-(4-methoxy-6-methylsulfonyl-2-pyridinyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 166132128
N-[3-[4-(3-hydroxy-3-methylbutoxy)-6-methylsulfonyl-2-pyridinyl]-1-methylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 170694268
N-[3-[4-[2-(3-fluorooxetan-3-yl)ethoxy]spiro[5,6-dihydropyrano[3,4-b]pyridine-8,3'-oxolane]-2-yl]-1-methylpyrrolo[2,3-c]pyridin-5-yl]acetamide
CID 170011606

Frequently Asked Questions

What is the IUPAC name of N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide?
The IUPAC name of N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide (CID 177028729) is N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide.
What is the SMILES notation for N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide?
The canonical SMILES for N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide is CCn1cc(-c2cc(C)nc(C3(F)CC3)n2)c2cc(NC(C)=O)ncc21.
What is the InChIKey of N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide?
The InChIKey is JDRWOJLISJKXLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN5O/c1-4-25-10-14(13-8-17(23-12(3)26)21-9-16(13)25)15-7-11(2)22-18(24-15)19(20)5-6-19/h7-10H,4-6H2,1-3H3,(H,21,23,26).
What are the key properties of N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide?
N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide has a molecular weight of 353.40 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-ethyl-3-[2-(1-fluorocyclopropyl)-6-methylpyrimidin-4-yl]pyrrolo[2,3-c]pyridin-5-yl]acetamide is sourced from PubChem (CID 177028729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).