N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide

C26H28N6O4 — CID 166129181

IUPACN-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide
SMILESCOc1ccc(NC(=O)C2CC2)cc1.COc1cnc(C2COC2)nc1Nc1n[nH]c2ccccc12
InChIInChI=1S/C15H15N5O2.C11H13NO2/c1-21-12-6-16-13(9-7-22-8-9)17-15(12)18-14-10-4-2-3-5-11(10)19-20-14;1-14-10-6-4-9(5-7-10)12-11(13)8-2-3-8/h2-6,9H,7-8H2,1H3,(H2,16,17,18,19,20);4-8H,2-3H2,1H3,(H,12,13)
InChIKeyDLZIHZFTMFONAN-UHFFFAOYSA-N
MW488.55 g/mol
LogP4.26
Rot. Bonds7

About N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide

N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide (PubChem CID 166129181) has the molecular formula C26H28N6O4 and a molecular weight of 488.55 g/mol. Its IUPAC name is N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide
PubChem CID166129181
Molecular FormulaC26H28N6O4
Molecular Weight488.55 g/mol
Exact Mass488.22
IUPAC NameN-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide
SMILESCOc1ccc(NC(=O)C2CC2)cc1.COc1cnc(C2COC2)nc1Nc1n[nH]c2ccccc12
InChIInChI=1S/C15H15N5O2.C11H13NO2/c1-21-12-6-16-13(9-7-22-8-9)17-15(12)18-14-10-4-2-3-5-11(10)19-20-14;1-14-10-6-4-9(5-7-10)12-11(13)8-2-3-8/h2-6,9H,7-8H2,1H3,(H2,16,17,18,19,20);4-8H,2-3H2,1H3,(H,12,13)
InChIKeyDLZIHZFTMFONAN-UHFFFAOYSA-N
XLogP4.26
TPSA123.28 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.55
LogP ≤ 54.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide 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-[2-(azetidin-1-yl)-5-methoxypyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166128826
N-(5-methoxy-2-methylpyrimidin-4-yl)-1H-indazol-3-amine;N-(4-methylphenyl)cyclopropanecarboxamide
CID 166129496
N-(4-methoxyphenyl)cyclopropanecarboxamide;N-(5-methoxy-2-thiomorpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine
CID 166129289
2-[5-(1H-indazol-3-ylamino)-6-methoxypyrazin-2-yl]ethanol;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166128442
N-(5-chloro-2-morpholin-4-ylpyrimidin-4-yl)-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166128780
N-[6-(2,6-dimethylmorpholin-4-yl)-5-methoxypyrimidin-4-yl]-1H-indazol-3-amine;ethane;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166128980
ethane;2-fluoro-4-(1H-indazol-3-ylamino)-5-methoxy-N,N-dimethylbenzamide;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166128483
ethane;2-[4-(1H-indazol-3-ylamino)-3-methoxypyrazol-1-yl]ethanol;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166129113
[5-(1H-indazol-3-ylamino)-6-methoxy-2-pyridinyl]-(2-oxa-6-azaspiro[3.3]heptan-6-yl)methanone;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166129323
ethane;1H-indazole;N-(4-methoxyphenyl)cyclopropanecarboxamide
CID 166129027
1-(1H-indazol-3-yl)-3-(4-methoxyphenyl)urea
CID 25197519
N-(1H-indazol-3-yl)cyclopentanecarboxamide
CID 60729859

Frequently Asked Questions

What is the IUPAC name of N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide?
The IUPAC name of N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide (CID 166129181) is N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide.
What is the SMILES notation for N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide?
The canonical SMILES for N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide is COc1ccc(NC(=O)C2CC2)cc1.COc1cnc(C2COC2)nc1Nc1n[nH]c2ccccc12.
What is the InChIKey of N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide?
The InChIKey is DLZIHZFTMFONAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2.C11H13NO2/c1-21-12-6-16-13(9-7-22-8-9)17-15(12)18-14-10-4-2-3-5-11(10)19-20-14;1-14-10-6-4-9(5-7-10)12-11(13)8-2-3-8/h2-6,9H,7-8H2,1H3,(H2,16,17,18,19,20);4-8H,2-3H2,1H3,(H,12,13).
What are the key properties of N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide?
N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide has a molecular weight of 488.55 g/mol, XLogP of 4.26, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methoxy-2-(oxetan-3-yl)pyrimidin-4-yl]-1H-indazol-3-amine;N-(4-methoxyphenyl)cyclopropanecarboxamide is sourced from PubChem (CID 166129181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).