(7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide

C19H21N5O — CID 124786935

IUPAC(7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
SMILESO=C(NC1CC1)[C@H]1CN(Cc2cccc3[nH]ccc23)Cc2ccnn21
InChIInChI=1S/C19H21N5O/c25-19(22-14-4-5-14)18-12-23(11-15-6-9-21-24(15)18)10-13-2-1-3-17-16(13)7-8-20-17/h1-3,6-9,14,18,20H,4-5,10-12H2,(H,22,25)/t18-/m1/s1
InChIKeyYWZISFZYAIHIQQ-GOSISDBHSA-N
MW335.41 g/mol
LogP2.20
Rot. Bonds4

About (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide

(7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide (PubChem CID 124786935) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide.

Molecular Properties

Compound Name(7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
PubChem CID124786935
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name(7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
SMILESO=C(NC1CC1)[C@H]1CN(Cc2cccc3[nH]ccc23)Cc2ccnn21
InChIInChI=1S/C19H21N5O/c25-19(22-14-4-5-14)18-12-23(11-15-6-9-21-24(15)18)10-13-2-1-3-17-16(13)7-8-20-17/h1-3,6-9,14,18,20H,4-5,10-12H2,(H,22,25)/t18-/m1/s1
InChIKeyYWZISFZYAIHIQQ-GOSISDBHSA-N
XLogP2.20
TPSA65.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
The IUPAC name of (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide (CID 124786935) is (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide.
What is the SMILES notation for (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
The canonical SMILES for (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide is O=C(NC1CC1)[C@H]1CN(Cc2cccc3[nH]ccc23)Cc2ccnn21.
What is the InChIKey of (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
The InChIKey is YWZISFZYAIHIQQ-GOSISDBHSA-N. The full InChI is InChI=1S/C19H21N5O/c25-19(22-14-4-5-14)18-12-23(11-15-6-9-21-24(15)18)10-13-2-1-3-17-16(13)7-8-20-17/h1-3,6-9,14,18,20H,4-5,10-12H2,(H,22,25)/t18-/m1/s1.
What are the key properties of (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
(7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-N-cyclopropyl-5-(1H-indol-4-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide is sourced from PubChem (CID 124786935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).