2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide

C24H23N5O3 — CID 121231328

IUPAC2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide
SMILESCC(C)n1cc(C(=O)c2ccnc(NC(=O)Cc3coc(C4CC4)n3)c2)c2cnccc21
InChIInChI=1S/C24H23N5O3/c1-14(2)29-12-19(18-11-25-7-6-20(18)29)23(31)16-5-8-26-21(9-16)28-22(30)10-17-13-32-24(27-17)15-3-4-15/h5-9,11-15H,3-4,10H2,1-2H3,(H,26,28,30)
InChIKeyPPKVTCREMKQHRR-UHFFFAOYSA-N
MW429.48 g/mol
LogP4.29
Rot. Bonds7

About 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide

2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide (PubChem CID 121231328) has the molecular formula C24H23N5O3 and a molecular weight of 429.48 g/mol. Its IUPAC name is 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide
PubChem CID121231328
Molecular FormulaC24H23N5O3
Molecular Weight429.48 g/mol
Exact Mass429.18
IUPAC Name2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide
SMILESCC(C)n1cc(C(=O)c2ccnc(NC(=O)Cc3coc(C4CC4)n3)c2)c2cnccc21
InChIInChI=1S/C24H23N5O3/c1-14(2)29-12-19(18-11-25-7-6-20(18)29)23(31)16-5-8-26-21(9-16)28-22(30)10-17-13-32-24(27-17)15-3-4-15/h5-9,11-15H,3-4,10H2,1-2H3,(H,26,28,30)
InChIKeyPPKVTCREMKQHRR-UHFFFAOYSA-N
XLogP4.29
TPSA102.91 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide?
The IUPAC name of 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide (CID 121231328) is 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide?
The canonical SMILES for 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide is CC(C)n1cc(C(=O)c2ccnc(NC(=O)Cc3coc(C4CC4)n3)c2)c2cnccc21.
What is the InChIKey of 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide?
The InChIKey is PPKVTCREMKQHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O3/c1-14(2)29-12-19(18-11-25-7-6-20(18)29)23(31)16-5-8-26-21(9-16)28-22(30)10-17-13-32-24(27-17)15-3-4-15/h5-9,11-15H,3-4,10H2,1-2H3,(H,26,28,30).
What are the key properties of 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide?
2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide has a molecular weight of 429.48 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-1,3-oxazol-4-yl)-N-[4-(1-propan-2-ylpyrrolo[3,2-c]pyridine-3-carbonyl)-2-pyridinyl]acetamide is sourced from PubChem (CID 121231328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).