cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone

C18H19N3O — CID 134690490

IUPACcyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone
SMILESCC(C)n1ccc(-c2cc(C(=O)C3CC3)c3ccccn23)n1
InChIInChI=1S/C18H19N3O/c1-12(2)21-10-8-15(19-21)17-11-14(18(22)13-6-7-13)16-5-3-4-9-20(16)17/h3-5,8-13H,6-7H2,1-2H3
InChIKeyWODWKCZRTYRLQD-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.98
Rot. Bonds4

About cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone

cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone (PubChem CID 134690490) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone
PubChem CID134690490
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Namecyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone
SMILESCC(C)n1ccc(-c2cc(C(=O)C3CC3)c3ccccn23)n1
InChIInChI=1S/C18H19N3O/c1-12(2)21-10-8-15(19-21)17-11-14(18(22)13-6-7-13)16-5-3-4-9-20(16)17/h3-5,8-13H,6-7H2,1-2H3
InChIKeyWODWKCZRTYRLQD-UHFFFAOYSA-N
XLogP3.98
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylmethyl)-3-(1-propan-2-ylpyrazol-3-yl)indolizine-1-carboxamide
CID 97446716
N-(3-methylphenyl)-3-(1-propan-2-ylpyrazol-3-yl)indolizine-1-carboxamide
CID 97446718
[3-[1-(cyclopropylmethyl)pyrazol-3-yl]indolizin-1-yl]-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 97446734
cyclopropyl-(2-propan-2-ylphenyl)methanone
CID 53437883
3-(cyclopropanecarbonyl)-N-phenylindolizine-1-carboxamide
CID 46838293
[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-[3-(2-propan-2-yl-1,3-thiazol-4-yl)indolizin-1-yl]methanone
CID 97446851
[3-(dimethylamino)pyrrolidin-1-yl]-[3-[1-(4-methoxyphenyl)pyrazol-3-yl]indolizin-1-yl]methanone
CID 131650381
[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-[3-[1-(4-methoxyphenyl)pyrazol-3-yl]indolizin-1-yl]methanone
CID 97446810
3-(1-cyclopentylpyrazol-3-yl)-N-methyl-N-(pyridin-2-ylmethyl)indolizine-1-carboxamide;2,2,2-trifluoroacetic acid
CID 155855355
3-(2-ethyl-1,3-thiazol-4-yl)indolizine-1-carboxylic acid
CID 121229439
1-cyclopropyl-3-(1-propan-2-ylpyrazol-3-yl)propan-1-one
CID 64773472
[3-(1-benzylimidazol-4-yl)indolizin-1-yl]-[4-(dimethylamino)piperidin-1-yl]methanone
CID 97446913

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone?
The IUPAC name of cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone (CID 134690490) is cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone is CC(C)n1ccc(-c2cc(C(=O)C3CC3)c3ccccn23)n1.
What is the InChIKey of cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone?
The InChIKey is WODWKCZRTYRLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-12(2)21-10-8-15(19-21)17-11-14(18(22)13-6-7-13)16-5-3-4-9-20(16)17/h3-5,8-13H,6-7H2,1-2H3.
What are the key properties of cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone?
cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone has a molecular weight of 293.37 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[3-(1-propan-2-ylpyrazol-3-yl)indolizin-1-yl]methanone is sourced from PubChem (CID 134690490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).