N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide

C20H22N6O — CID 138590190

IUPACN-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide
SMILESO=C(CN1CCCC1)Nc1cc2cc(-c3cnn(C4CC4)c3)ncc2cn1
InChIInChI=1S/C20H22N6O/c27-20(13-25-5-1-2-6-25)24-19-8-14-7-18(21-9-15(14)10-22-19)16-11-23-26(12-16)17-3-4-17/h7-12,17H,1-6,13H2,(H,22,24,27)
InChIKeyXXBPDDVUWFYIEW-UHFFFAOYSA-N
MW362.44 g/mol
LogP2.86
Rot. Bonds5

About N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide

N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide (PubChem CID 138590190) has the molecular formula C20H22N6O and a molecular weight of 362.44 g/mol. Its IUPAC name is N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide
PubChem CID138590190
Molecular FormulaC20H22N6O
Molecular Weight362.44 g/mol
Exact Mass362.19
IUPAC NameN-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide
SMILESO=C(CN1CCCC1)Nc1cc2cc(-c3cnn(C4CC4)c3)ncc2cn1
InChIInChI=1S/C20H22N6O/c27-20(13-25-5-1-2-6-25)24-19-8-14-7-18(21-9-15(14)10-22-19)16-11-23-26(12-16)17-3-4-17/h7-12,17H,1-6,13H2,(H,22,24,27)
InChIKeyXXBPDDVUWFYIEW-UHFFFAOYSA-N
XLogP2.86
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-methyl-1,4-diazepan-1-yl)-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]acetamide
CID 138587782
2-(4-methylpiperazin-1-yl)-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]acetamide
CID 138591471
2-(3-fluoropyrrolidin-1-yl)-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]acetamide
CID 138588734
N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-[(2R)-2-methylpyrrolidin-1-yl]acetamide
CID 138587844
N-[6-(2-methyl-1,3-oxazol-5-yl)-2,7-naphthyridin-3-yl]-2-piperidin-1-ylacetamide
CID 138590602
1-(2-methylpropyl)-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]azepane-4-carboxamide
CID 138588754
4-amino-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclohexane-1-carboxamide
CID 138587611
1-(2-methylpropyl)-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]piperidine-3-carboxamide
CID 138587966
4-(difluoromethoxy)-N-[6-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-2,7-naphthyridin-3-yl]benzamide
CID 138587038
4,4-difluoro-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclohexane-1-carboxamide
CID 138591258
4-(dimethylamino)-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclohexane-1-carboxamide
CID 138586982
3-methyl-N-[6-(1-methylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-3,8-diazabicyclo[3.2.1]octane-8-carboxamide
CID 138588848

Frequently Asked Questions

What is the IUPAC name of N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide (CID 138590190) is N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide is O=C(CN1CCCC1)Nc1cc2cc(-c3cnn(C4CC4)c3)ncc2cn1.
What is the InChIKey of N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide?
The InChIKey is XXBPDDVUWFYIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O/c27-20(13-25-5-1-2-6-25)24-19-8-14-7-18(21-9-15(14)10-22-19)16-11-23-26(12-16)17-3-4-17/h7-12,17H,1-6,13H2,(H,22,24,27).
What are the key properties of N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide?
N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide has a molecular weight of 362.44 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1-cyclopropylpyrazol-4-yl)-2,7-naphthyridin-3-yl]-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 138590190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).