N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide

C24H22N4O — CID 167862401

IUPACN-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide
SMILESO=C(Nc1cc2n(n1)CCN(Cc1ccccc1)C2)c1cccc2ccccc12
InChIInChI=1S/C24H22N4O/c29-24(22-12-6-10-19-9-4-5-11-21(19)22)25-23-15-20-17-27(13-14-28(20)26-23)16-18-7-2-1-3-8-18/h1-12,15H,13-14,16-17H2,(H,25,26,29)
InChIKeyDWOCJVSOMFIPFR-UHFFFAOYSA-N
MW382.47 g/mol
LogP4.30
Rot. Bonds4

About N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide

N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide (PubChem CID 167862401) has the molecular formula C24H22N4O and a molecular weight of 382.47 g/mol. Its IUPAC name is N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide
PubChem CID167862401
Molecular FormulaC24H22N4O
Molecular Weight382.47 g/mol
Exact Mass382.18
IUPAC NameN-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide
SMILESO=C(Nc1cc2n(n1)CCN(Cc1ccccc1)C2)c1cccc2ccccc12
InChIInChI=1S/C24H22N4O/c29-24(22-12-6-10-19-9-4-5-11-21(19)22)25-23-15-20-17-27(13-14-28(20)26-23)16-18-7-2-1-3-8-18/h1-12,15H,13-14,16-17H2,(H,25,26,29)
InChIKeyDWOCJVSOMFIPFR-UHFFFAOYSA-N
XLogP4.30
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.47
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-benzylpiperazin-1-yl)-5-bromophenyl]naphthalene-1-carboxamide
CID 11496999
N-[2-(4-benzylpiperazin-1-yl)-5-phenylphenyl]naphthalene-1-carboxamide
CID 11584133
5-benzyl-2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 137452745
5-benzyl-N-[1-(hydroxymethyl)cyclopentyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carboxamide
CID 50985031
N-[4-(morpholin-4-ylmethyl)phenyl]naphthalene-1-carboxamide
CID 851463
1-(5-benzyl-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepin-2-yl)-3-[4-(4-hydroxyphenyl)butan-2-yl]urea
CID 167766339
N-(6-chloro-2-pyridinyl)naphthalene-1-carboxamide
CID 115683288
N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]naphthalene-1-carboxamide
CID 108760742
4-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-2-carbonyl)-1-methylpiperazin-2-one
CID 56720323
(4-benzylpiperazin-1-yl)-naphthalen-1-ylmethanethione
CID 3273462
5-benzyl-2-(4-bromophenyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 171367238
1-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)-2-methylsulfonylethanol
CID 90653864

Frequently Asked Questions

What is the IUPAC name of N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide?
The IUPAC name of N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide (CID 167862401) is N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide?
The canonical SMILES for N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide is O=C(Nc1cc2n(n1)CCN(Cc1ccccc1)C2)c1cccc2ccccc12.
What is the InChIKey of N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide?
The InChIKey is DWOCJVSOMFIPFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O/c29-24(22-12-6-10-19-9-4-5-11-21(19)22)25-23-15-20-17-27(13-14-28(20)26-23)16-18-7-2-1-3-8-18/h1-12,15H,13-14,16-17H2,(H,25,26,29).
What are the key properties of N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide?
N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide has a molecular weight of 382.47 g/mol, XLogP of 4.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-benzyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl)naphthalene-1-carboxamide is sourced from PubChem (CID 167862401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).