7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine

C18H25N5O — CID 118739028

IUPAC7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
SMILESCCn1cc2c(n1)C(COCC1CC1)CN(c1ccc(C)nn1)C2
InChIInChI=1S/C18H25N5O/c1-3-23-10-15-8-22(17-7-4-13(2)19-20-17)9-16(18(15)21-23)12-24-11-14-5-6-14/h4,7,10,14,16H,3,5-6,8-9,11-12H2,1-2H3
InChIKeyQVAHMQDVTKRVDF-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.53
Rot. Bonds6

About 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine

7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine (PubChem CID 118739028) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
PubChem CID118739028
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
SMILESCCn1cc2c(n1)C(COCC1CC1)CN(c1ccc(C)nn1)C2
InChIInChI=1S/C18H25N5O/c1-3-23-10-15-8-22(17-7-4-13(2)19-20-17)9-16(18(15)21-23)12-24-11-14-5-6-14/h4,7,10,14,16H,3,5-6,8-9,11-12H2,1-2H3
InChIKeyQVAHMQDVTKRVDF-UHFFFAOYSA-N
XLogP2.53
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine (CID 118739028) is 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine is CCn1cc2c(n1)C(COCC1CC1)CN(c1ccc(C)nn1)C2.
What is the InChIKey of 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
The InChIKey is QVAHMQDVTKRVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-3-23-10-15-8-22(17-7-4-13(2)19-20-17)9-16(18(15)21-23)12-24-11-14-5-6-14/h4,7,10,14,16H,3,5-6,8-9,11-12H2,1-2H3.
What are the key properties of 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine?
7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine has a molecular weight of 327.43 g/mol, XLogP of 2.53, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 118739028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).