[(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone

C19H21N5O — CID 124819603

IUPAC[(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone
SMILESCN(C)C[C@@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn21
InChIInChI=1S/C19H21N5O/c1-22(2)11-16-13-23(12-15-9-10-20-24(15)16)19(25)18-8-7-14-5-3-4-6-17(14)21-18/h3-10,16H,11-13H2,1-2H3/t16-/m1/s1
InChIKeyUYOSICSDJNNISD-MRXNPFEDSA-N
MW335.41 g/mol
LogP2.19
Rot. Bonds3

About [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone

[(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone (PubChem CID 124819603) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone.

Molecular Properties

Compound Name[(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone
PubChem CID124819603
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name[(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone
SMILESCN(C)C[C@@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn21
InChIInChI=1S/C19H21N5O/c1-22(2)11-16-13-23(12-15-9-10-20-24(15)16)19(25)18-8-7-14-5-3-4-6-17(14)21-18/h3-10,16H,11-13H2,1-2H3/t16-/m1/s1
InChIKeyUYOSICSDJNNISD-MRXNPFEDSA-N
XLogP2.19
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone with MolForge

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Related Compounds

(7-methoxy-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepin-5-yl)-quinolin-2-ylmethanone
CID 131638697
2-(1-benzothiophen-3-yl)-1-[7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]ethanone
CID 131660849
(6-chloroimidazo[1,2-a]pyridin-2-yl)-[7-[2-(dimethylamino)ethyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone
CID 133140523
[7-(diethylaminomethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-pyrimidin-4-ylmethanone
CID 133140812
2-(1,3-benzodioxol-5-yl)-1-[(7S)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]ethanone
CID 124814359
[7-(diethylaminomethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-(2,6-dimethyl-4-pyridinyl)methanone
CID 131640417
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-quinolin-2-ylmethanone
CID 40744893
N,N-dimethyl-1-(5-pyrimidin-2-yl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl)methanamine
CID 133137722
N-methyl-N-[1-(quinoline-2-carbonyl)piperidin-4-yl]methanesulfonamide
CID 48734257
[7-benzyl-5-[(dimethylamino)methyl]-2,7-diazaspiro[3.4]octan-2-yl]-quinolin-2-ylmethanone;hydrochloride
CID 146065027
2-[5-(3-hydroxybenzoyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]-N,N-dimethylacetamide
CID 131693452
2-[[1-(quinoline-2-carbonyl)azetidin-3-yl]methyl]pyridazin-3-one
CID 126926685

Frequently Asked Questions

What is the IUPAC name of [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone?
The IUPAC name of [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone (CID 124819603) is [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone.
What is the SMILES notation for [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone?
The canonical SMILES for [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone is CN(C)C[C@@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn21.
What is the InChIKey of [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone?
The InChIKey is UYOSICSDJNNISD-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H21N5O/c1-22(2)11-16-13-23(12-15-9-10-20-24(15)16)19(25)18-8-7-14-5-3-4-6-17(14)21-18/h3-10,16H,11-13H2,1-2H3/t16-/m1/s1.
What are the key properties of [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone?
[(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone has a molecular weight of 335.41 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(7R)-7-[(dimethylamino)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]-quinolin-2-ylmethanone is sourced from PubChem (CID 124819603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).