5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide

C19H25N5O2 — CID 175017160

IUPAC5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide
SMILESNC(=O)c1c(C2CCc3ccccc3C2)nn(CC2CNCCO2)c1N
InChIInChI=1S/C19H25N5O2/c20-18-16(19(21)25)17(23-24(18)11-15-10-22-7-8-26-15)14-6-5-12-3-1-2-4-13(12)9-14/h1-4,14-15,22H,5-11,20H2,(H2,21,25)
InChIKeyGMUXRFLIXWEOAG-UHFFFAOYSA-N
MW355.44 g/mol
LogP0.83
Rot. Bonds4

About 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide

5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide (PubChem CID 175017160) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide
PubChem CID175017160
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide
SMILESNC(=O)c1c(C2CCc3ccccc3C2)nn(CC2CNCCO2)c1N
InChIInChI=1S/C19H25N5O2/c20-18-16(19(21)25)17(23-24(18)11-15-10-22-7-8-26-15)14-6-5-12-3-1-2-4-13(12)9-14/h1-4,14-15,22H,5-11,20H2,(H2,21,25)
InChIKeyGMUXRFLIXWEOAG-UHFFFAOYSA-N
XLogP0.83
TPSA108.19 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide (CID 175017160) is 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide is NC(=O)c1c(C2CCc3ccccc3C2)nn(CC2CNCCO2)c1N.
What is the InChIKey of 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide?
The InChIKey is GMUXRFLIXWEOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c20-18-16(19(21)25)17(23-24(18)11-15-10-22-7-8-26-15)14-6-5-12-3-1-2-4-13(12)9-14/h1-4,14-15,22H,5-11,20H2,(H2,21,25).
What are the key properties of 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide?
5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 0.83, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(morpholin-2-ylmethyl)-3-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 175017160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).