7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine

C17H23N5O — CID 118746829

IUPAC7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
SMILESCCn1ncc2c1C(COCC1CC1)CN(c1ccncn1)C2
InChIInChI=1S/C17H23N5O/c1-2-22-17-14(7-20-22)8-21(16-5-6-18-12-19-16)9-15(17)11-23-10-13-3-4-13/h5-7,12-13,15H,2-4,8-11H2,1H3
InChIKeyZGNMAWACCMMHSE-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.22
Rot. Bonds6

About 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine

7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine (PubChem CID 118746829) has the molecular formula C17H23N5O and a molecular weight of 313.40 g/mol. Its IUPAC name is 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine.

Molecular Properties

Compound Name7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
PubChem CID118746829
Molecular FormulaC17H23N5O
Molecular Weight313.40 g/mol
Exact Mass313.19
IUPAC Name7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
SMILESCCn1ncc2c1C(COCC1CC1)CN(c1ccncn1)C2
InChIInChI=1S/C17H23N5O/c1-2-22-17-14(7-20-22)8-21(16-5-6-18-12-19-16)9-15(17)11-23-10-13-3-4-13/h5-7,12-13,15H,2-4,8-11H2,1H3
InChIKeyZGNMAWACCMMHSE-UHFFFAOYSA-N
XLogP2.22
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-2-(pyrazol-1-ylmethyl)morpholine
CID 53566151
N-[[6-(oxan-4-yl)-1-propan-2-yl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methyl]pyrimidin-2-amine
CID 97405077
7-(ethoxymethyl)-2-ethyl-5-(5-fluoropyrimidin-2-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 118739022
7-(cyclopropylmethoxymethyl)-2-ethyl-5-(6-methylpyridazin-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 118739028
1-(cyclopropylmethyl)-7-(methoxymethyl)-5-pyrimidin-2-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
CID 118740754
7-(cyclopropylmethoxymethyl)-5-(5-fluoropyrimidin-2-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
CID 118740755
7-(ethoxymethyl)-1-(oxan-4-ylmethyl)-5-pyrimidin-2-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
CID 118741068
1-(cyclopropylmethyl)-7-(ethoxymethyl)-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 118741200
[7-(ethoxymethyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl]-pyrimidin-4-ylmethanone
CID 118742658
[7-(cyclopropylmethoxymethyl)-1-ethyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl]-pyrimidin-4-ylmethanone
CID 118745120
[7-(ethoxymethyl)-1-ethyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-5-yl]-pyrimidin-4-ylmethanone
CID 118745146
7-(cyclopropylmethoxymethyl)-1-methyl-5-pyrimidin-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine
CID 118746030

Frequently Asked Questions

What is the IUPAC name of 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine?
The IUPAC name of 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine (CID 118746829) is 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine.
What is the SMILES notation for 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine?
The canonical SMILES for 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine is CCn1ncc2c1C(COCC1CC1)CN(c1ccncn1)C2.
What is the InChIKey of 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine?
The InChIKey is ZGNMAWACCMMHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O/c1-2-22-17-14(7-20-22)8-21(16-5-6-18-12-19-16)9-15(17)11-23-10-13-3-4-13/h5-7,12-13,15H,2-4,8-11H2,1H3.
What are the key properties of 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine?
7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine has a molecular weight of 313.40 g/mol, XLogP of 2.22, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopropylmethoxymethyl)-1-ethyl-5-pyrimidin-4-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine is sourced from PubChem (CID 118746829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).