(2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone

C11H17N3O — CID 116580054

IUPAC(2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone
SMILESCCn1cc(C(=O)C2CCCC2N)cn1
InChIInChI=1S/C11H17N3O/c1-2-14-7-8(6-13-14)11(15)9-4-3-5-10(9)12/h6-7,9-10H,2-5,12H2,1H3
InChIKeyRSMJQRKGVUSCHX-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.21
Rot. Bonds3

About (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone

(2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone (PubChem CID 116580054) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone.

Molecular Properties

Compound Name(2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone
PubChem CID116580054
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name(2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone
SMILESCCn1cc(C(=O)C2CCCC2N)cn1
InChIInChI=1S/C11H17N3O/c1-2-14-7-8(6-13-14)11(15)9-4-3-5-10(9)12/h6-7,9-10H,2-5,12H2,1H3
InChIKeyRSMJQRKGVUSCHX-UHFFFAOYSA-N
XLogP1.21
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-aminooxolan-3-yl)-(1-ethylpyrazol-4-yl)methanone
CID 116587363
cyclooctyl-(1-ethylpyrazol-4-yl)methanone
CID 80602225
7-azabicyclo[2.2.1]heptan-2-yl-(1-ethylpyrazol-4-yl)methanone
CID 116575868
1-[1-(cyclobutylmethyl)pyrazol-4-yl]propan-1-one
CID 65462054
[(3S)-3-aminopyrrolidin-1-yl]-(1-ethylpyrazol-4-yl)methanone
CID 119934311
(2,2-dimethylcyclopentyl)-(1-ethylpyrazol-4-yl)methanone
CID 107186691
(1-ethylpyrazol-4-yl)-(thiolan-3-yl)methanone
CID 105083220
(1,1-dioxothiolan-3-yl)-(1-ethylpyrazol-4-yl)methanone
CID 115336218
[5-(aminomethyl)oxolan-2-yl]-(1-ethylpyrazol-4-yl)methanone
CID 116589035
1-(1-ethylpyrazol-4-yl)ethanone
CID 4912928
(1-ethylpyrazol-4-yl)-(3-methyl-1,4-dithian-2-yl)methanone
CID 115385636
3-cyclohexyl-1-(1-ethylpyrazol-4-yl)propan-1-one
CID 114964350

Frequently Asked Questions

What is the IUPAC name of (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone?
The IUPAC name of (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone (CID 116580054) is (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone.
What is the SMILES notation for (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone?
The canonical SMILES for (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone is CCn1cc(C(=O)C2CCCC2N)cn1.
What is the InChIKey of (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone?
The InChIKey is RSMJQRKGVUSCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-2-14-7-8(6-13-14)11(15)9-4-3-5-10(9)12/h6-7,9-10H,2-5,12H2,1H3.
What are the key properties of (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone?
(2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone has a molecular weight of 207.28 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminocyclopentyl)-(1-ethylpyrazol-4-yl)methanone is sourced from PubChem (CID 116580054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).