2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine

C17H21N5O — CID 71914447

IUPAC2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine
SMILESCOCCN(C)c1ccc(NCc2cccc3cn[nH]c23)nc1
InChIInChI=1S/C17H21N5O/c1-22(8-9-23-2)15-6-7-16(19-12-15)18-10-13-4-3-5-14-11-20-21-17(13)14/h3-7,11-12H,8-10H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyWSIHJGJLTMYQHF-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.65
Rot. Bonds7

About 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine

2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine (PubChem CID 71914447) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine
PubChem CID71914447
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC Name2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine
SMILESCOCCN(C)c1ccc(NCc2cccc3cn[nH]c23)nc1
InChIInChI=1S/C17H21N5O/c1-22(8-9-23-2)15-6-7-16(19-12-15)18-10-13-4-3-5-14-11-20-21-17(13)14/h3-7,11-12H,8-10H2,1-2H3,(H,18,19)(H,20,21)
InChIKeyWSIHJGJLTMYQHF-UHFFFAOYSA-N
XLogP2.65
TPSA66.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine 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

Entospletinib
CID 59473233
Elimusertib
CID 118869362
Apy0201
CID 56927660
1-[3-(2-Methylpyridin-4-Yl)-1~{h}-Pyrazolo[4,3-C]pyridin-6-Yl]-3-(Phenylmethyl)urea
CID 71555247
3-(1H-Indazol-5-yl)-N-propylimidazo(1,2-b)pyridazin-6-amine
CID 70679308
N-[2-(4-Methoxypiperidin-1-Yl)pyrimidin-4-Yl]-2-(1h-Pyrazol-4-Yl)-1h-Pyrrolo[3,2-C]pyridin-6-Amine
CID 86278567
5-[4-(Aminomethyl)-1-piperidinyl]-1-(2-ethoxyethyl)-3-ethyl-N-(4-methyl-2-pyridinyl)-1H-pyrazolo[4,3-d]pyrimidin-7-amine
CID 11568346
5-(4-aminopiperidin-1-yl)-1-(2-ethoxyethyl)-3-ethyl-N-(4-methylpyridin-2-yl)-1H-pyrazolo[4,3-d]pyrimidin-7-amine
CID 11575452
1-(2-ethoxyethyl)-3-ethyl-N5-(1-methylpiperidin-4-yl)-N7-(4-methylpyridin-2-yl)-1H-pyrazolo[4,3-d]pyrimidine-5,7-diamine
CID 11647832
5-(1,4-diazepan-1-yl)-1-(2-ethoxyethyl)-3-ethyl-N-(4-methylpyridin-2-yl)-1H-pyrazolo[4,3-d]pyrimidin-7-amine
CID 11690391
N2-(2,6-dimorpholinopyridin-4-yl)-N4-(1H-indazol-4-yl)-N4-methylpyrimidine-2,4-diamine
CID 42645046
1-(2-ethoxyethyl)-3-ethyl-N-(4-methyl-2-pyridinyl)-5-piperazin-1-ylpyrazolo[4,5-d]pyrimidin-7-amine
CID 46887035

Frequently Asked Questions

What is the IUPAC name of 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine?
The IUPAC name of 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine (CID 71914447) is 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine.
What is the SMILES notation for 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine?
The canonical SMILES for 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine is COCCN(C)c1ccc(NCc2cccc3cn[nH]c23)nc1.
What is the InChIKey of 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine?
The InChIKey is WSIHJGJLTMYQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c1-22(8-9-23-2)15-6-7-16(19-12-15)18-10-13-4-3-5-14-11-20-21-17(13)14/h3-7,11-12H,8-10H2,1-2H3,(H,18,19)(H,20,21).
What are the key properties of 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine?
2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine has a molecular weight of 311.39 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1H-indazol-7-ylmethyl)-5-N-(2-methoxyethyl)-5-N-methylpyridine-2,5-diamine is sourced from PubChem (CID 71914447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).