1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine

C10H16ClN3 — CID 105467292

IUPAC1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
SMILESCCn1ncc(CCC2(N)CC2)c1Cl
InChIInChI=1S/C10H16ClN3/c1-2-14-9(11)8(7-13-14)3-4-10(12)5-6-10/h7H,2-6,12H2,1H3
InChIKeyNVPCFKUSOZVGOZ-UHFFFAOYSA-N
MW213.71 g/mol
LogP1.98
Rot. Bonds4

About 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine

1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine (PubChem CID 105467292) has the molecular formula C10H16ClN3 and a molecular weight of 213.71 g/mol. Its IUPAC name is 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
PubChem CID105467292
Molecular FormulaC10H16ClN3
Molecular Weight213.71 g/mol
Exact Mass213.10
IUPAC Name1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
SMILESCCn1ncc(CCC2(N)CC2)c1Cl
InChIInChI=1S/C10H16ClN3/c1-2-14-9(11)8(7-13-14)3-4-10(12)5-6-10/h7H,2-6,12H2,1H3
InChIKeyNVPCFKUSOZVGOZ-UHFFFAOYSA-N
XLogP1.98
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-chloro-1-ethylpyrazol-4-yl)-N-methylethanamine
CID 84770611
1-(5-chloro-1-ethylpyrazol-4-yl)cyclohexan-1-amine
CID 84791977
1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]piperazine
CID 84801861
N-[(5-chloro-1-ethylpyrazol-4-yl)methyl]hydroxylamine
CID 84767030
2-(5-chloro-1-propylpyrazol-4-yl)ethanamine
CID 115017423
2-(5-chloro-1-ethylpyrazol-4-yl)propan-2-amine
CID 84770615
1-[2-(5-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine
CID 105438888
1-[2-(5-chloro-2-methoxy-4-pyridinyl)ethyl]cyclopropan-1-amine
CID 105484217
1-[2-(3-chloro-2,5-dimethylphenyl)ethyl]cyclopropan-1-amine
CID 105481526
1-[2-(1,3-dimethylpyrazol-4-yl)ethyl]cyclopropan-1-amine
CID 105438423
1-[2-(3-chloro-2,4-dimethylphenyl)ethyl]cyclopropan-1-amine
CID 105481536
3-[5-chloro-1-(2,2-dimethylpropyl)pyrazol-4-yl]propan-1-amine
CID 115068517

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine (CID 105467292) is 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine is CCn1ncc(CCC2(N)CC2)c1Cl.
What is the InChIKey of 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
The InChIKey is NVPCFKUSOZVGOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3/c1-2-14-9(11)8(7-13-14)3-4-10(12)5-6-10/h7H,2-6,12H2,1H3.
What are the key properties of 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine?
1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine has a molecular weight of 213.71 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-chloro-1-ethylpyrazol-4-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105467292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).