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

C17H25N5O — CID 118746173

IUPAC4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
SMILESCn1cc(CN2Cc3c(cnn3C)C(COCC3CC3)C2)cn1
InChIInChI=1S/C17H25N5O/c1-20-7-14(5-18-20)8-22-9-15(12-23-11-13-3-4-13)16-6-19-21(2)17(16)10-22/h5-7,13,15H,3-4,8-12H2,1-2H3
InChIKeyHBILMVLEHUUPKS-UHFFFAOYSA-N
MW315.42 g/mol
LogP1.68
Rot. Bonds6

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

4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine (PubChem CID 118746173) has the molecular formula C17H25N5O and a molecular weight of 315.42 g/mol. Its IUPAC name is 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
PubChem CID118746173
Molecular FormulaC17H25N5O
Molecular Weight315.42 g/mol
Exact Mass315.21
IUPAC Name4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
SMILESCn1cc(CN2Cc3c(cnn3C)C(COCC3CC3)C2)cn1
InChIInChI=1S/C17H25N5O/c1-20-7-14(5-18-20)8-22-9-15(12-23-11-13-3-4-13)16-6-19-21(2)17(16)10-22/h5-7,13,15H,3-4,8-12H2,1-2H3
InChIKeyHBILMVLEHUUPKS-UHFFFAOYSA-N
XLogP1.68
TPSA48.11 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-(cyclopropylmethoxymethyl)-8-[(1-methylpyrazol-4-yl)methyl]-5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepine
CID 131648823
5-(cyclopropylmethoxymethyl)-7-[(1-methylpyrazol-4-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 131640574
1-[4-(cyclopropylmethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-2-methylsulfonylethanone
CID 131662817
1-[(4S)-4-(cyclopropylmethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-2-methylsulfonylethanone
CID 97368146
(4S)-4-(ethoxymethyl)-1-methyl-6-(2-phenylethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
CID 97408465
N,N-dimethyl-2-[[(7R)-1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-triazolo[4,5-c]pyridin-7-yl]methoxy]ethanamine
CID 97383300
N,N-dimethyl-2-[[(7S)-1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-triazolo[4,5-c]pyridin-7-yl]methoxy]ethanamine
CID 97383301
7-(cyclopropylmethoxymethyl)-5-[(1-methylpyrazol-4-yl)methyl]-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine;2,2,2-trifluoroacetic acid
CID 155832312
6-(cyclopropylmethoxymethyl)-8-[(1-methylpyrazol-4-yl)methyl]-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepine;2,2,2-trifluoroacetic acid
CID 155832789
5-[[4-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]methyl]-4-methyl-1,3-thiazole
CID 131658022
4-(ethoxymethyl)-2-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine;2,2,2-trifluoroacetic acid
CID 118745467
(4R)-4-(cyclopropylmethoxymethyl)-2-ethyl-6-(pyridin-4-ylmethyl)-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine
CID 97383074

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The IUPAC name of 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine (CID 118746173) is 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine.
What is the SMILES notation for 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The canonical SMILES for 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine is Cn1cc(CN2Cc3c(cnn3C)C(COCC3CC3)C2)cn1.
What is the InChIKey of 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
The InChIKey is HBILMVLEHUUPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O/c1-20-7-14(5-18-20)8-22-9-15(12-23-11-13-3-4-13)16-6-19-21(2)17(16)10-22/h5-7,13,15H,3-4,8-12H2,1-2H3.
What are the key properties of 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine?
4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine has a molecular weight of 315.42 g/mol, XLogP of 1.68, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethoxymethyl)-1-methyl-6-[(1-methylpyrazol-4-yl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine is sourced from PubChem (CID 118746173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).