ethane;1-ethyl-3-propan-2-ylpyrazole

C10H20N2 — CID 143299826

IUPACethane;1-ethyl-3-propan-2-ylpyrazole
SMILESCC.CCn1ccc(C(C)C)n1
InChIInChI=1S/C8H14N2.C2H6/c1-4-10-6-5-8(9-10)7(2)3;1-2/h5-7H,4H2,1-3H3;1-2H3
InChIKeyILIDZWYPJXEFQX-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.05
Rot. Bonds2

About ethane;1-ethyl-3-propan-2-ylpyrazole

ethane;1-ethyl-3-propan-2-ylpyrazole (PubChem CID 143299826) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is ethane;1-ethyl-3-propan-2-ylpyrazole.

Molecular Properties

Compound Nameethane;1-ethyl-3-propan-2-ylpyrazole
PubChem CID143299826
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Nameethane;1-ethyl-3-propan-2-ylpyrazole
SMILESCC.CCn1ccc(C(C)C)n1
InChIInChI=1S/C8H14N2.C2H6/c1-4-10-6-5-8(9-10)7(2)3;1-2/h5-7H,4H2,1-3H3;1-2H3
InChIKeyILIDZWYPJXEFQX-UHFFFAOYSA-N
XLogP3.05
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(difluoromethyl)-3-propan-2-ylpyrazole;1-ethyl-3-propan-2-ylpyrazole
CID 169237555
1-hexyl-3-propan-2-ylpyrazole
CID 122705458
1-[(methyldisulfanyl)methyl]-3-propan-2-ylpyrazole
CID 135280626
(1R)-1-(1-ethylpyrazol-3-yl)propane-1,3-diol
CID 129418649
1-(3-methoxypropyl)-3-propan-2-ylpyrazole
CID 129255782
argon;ethane;1-ethyl-3-methylpyrazole
CID 160730731
1-butan-2-yl-3-propan-2-ylpyrazole
CID 66015540
1-(3-phenylpropyl)-3-propan-2-ylpyrazole
CID 66014343
1-ethyl-3-methylpyrazole
CID 12002774
1-(1-ethylpyrazol-3-yl)-N-(furan-2-ylmethyl)ethanamine
CID 19626659
1-(difluoromethyl)-2-[(3-propan-2-ylpyrazol-1-yl)methyl]imidazole
CID 71909756
N-butan-2-yl-1-ethylpyrazol-3-amine
CID 130496120

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-3-propan-2-ylpyrazole?
The IUPAC name of ethane;1-ethyl-3-propan-2-ylpyrazole (CID 143299826) is ethane;1-ethyl-3-propan-2-ylpyrazole.
What is the SMILES notation for ethane;1-ethyl-3-propan-2-ylpyrazole?
The canonical SMILES for ethane;1-ethyl-3-propan-2-ylpyrazole is CC.CCn1ccc(C(C)C)n1.
What is the InChIKey of ethane;1-ethyl-3-propan-2-ylpyrazole?
The InChIKey is ILIDZWYPJXEFQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2.C2H6/c1-4-10-6-5-8(9-10)7(2)3;1-2/h5-7H,4H2,1-3H3;1-2H3.
What are the key properties of ethane;1-ethyl-3-propan-2-ylpyrazole?
ethane;1-ethyl-3-propan-2-ylpyrazole has a molecular weight of 168.28 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-3-propan-2-ylpyrazole is sourced from PubChem (CID 143299826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).