2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone

C14H23N3O2 — CID 114669614

IUPAC2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone
SMILESCCCn1ncc(OC)c1C(=O)CC1(N)CCCC1
InChIInChI=1S/C14H23N3O2/c1-3-8-17-13(12(19-2)10-16-17)11(18)9-14(15)6-4-5-7-14/h10H,3-9,15H2,1-2H3
InChIKeyKJJNKBRSZPNYEL-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.15
Rot. Bonds6

About 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone

2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone (PubChem CID 114669614) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone
PubChem CID114669614
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone
SMILESCCCn1ncc(OC)c1C(=O)CC1(N)CCCC1
InChIInChI=1S/C14H23N3O2/c1-3-8-17-13(12(19-2)10-16-17)11(18)9-14(15)6-4-5-7-14/h10H,3-9,15H2,1-2H3
InChIKeyKJJNKBRSZPNYEL-UHFFFAOYSA-N
XLogP2.15
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-aminocyclohexyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)ethanone
CID 114669627
(4-methoxy-1-propylpyrazol-5-yl)-(1-methylcyclohexyl)methanone
CID 106829733
1-(4-methoxy-1-propylpyrazol-5-yl)decan-1-one
CID 115810940
(3-ethylpyrrolidin-3-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 114669216
2-(tert-butylamino)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone
CID 114670106
cyclohexyl-(4-methoxy-1-propylpyrazol-5-yl)methanone
CID 114639235
2-(2-fluorophenyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone
CID 114639487
4-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-one
CID 105133556
1-(4-methoxy-1-propylpyrazol-5-yl)-2-thiophen-2-ylethanone
CID 114639732
3-amino-1-(4-methoxy-1-propylpyrazol-5-yl)-2-methylpropan-1-one
CID 114668938
2-(1-aminocyclohexyl)-1-(2,6-dimethoxyphenyl)ethanone
CID 116811535
2-(1-aminocyclopentyl)-1-(4-chloro-1-methylpyrazol-5-yl)ethanone
CID 114669615

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone?
The IUPAC name of 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone (CID 114669614) is 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone.
What is the SMILES notation for 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone?
The canonical SMILES for 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone is CCCn1ncc(OC)c1C(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone?
The InChIKey is KJJNKBRSZPNYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-3-8-17-13(12(19-2)10-16-17)11(18)9-14(15)6-4-5-7-14/h10H,3-9,15H2,1-2H3.
What are the key properties of 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone?
2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone has a molecular weight of 265.36 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-1-(4-methoxy-1-propylpyrazol-5-yl)ethanone is sourced from PubChem (CID 114669614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).