2,5-di(propan-2-yl)-1,5-dihydropyrazole

C9H18N2 — CID 162502737

IUPAC2,5-di(propan-2-yl)-1,5-dihydropyrazole
SMILESCC(C)C1C=CN(C(C)C)N1
InChIInChI=1S/C9H18N2/c1-7(2)9-5-6-11(10-9)8(3)4/h5-10H,1-4H3
InChIKeyUYJRPOHJXBJRJD-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.75
Rot. Bonds2

About 2,5-di(propan-2-yl)-1,5-dihydropyrazole

2,5-di(propan-2-yl)-1,5-dihydropyrazole (PubChem CID 162502737) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2,5-di(propan-2-yl)-1,5-dihydropyrazole.

Molecular Properties

Compound Name2,5-di(propan-2-yl)-1,5-dihydropyrazole
PubChem CID162502737
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2,5-di(propan-2-yl)-1,5-dihydropyrazole
SMILESCC(C)C1C=CN(C(C)C)N1
InChIInChI=1S/C9H18N2/c1-7(2)9-5-6-11(10-9)8(3)4/h5-10H,1-4H3
InChIKeyUYJRPOHJXBJRJD-UHFFFAOYSA-N
XLogP1.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl-5-Isopropylpyrazolin
CID 129649373
3-Methyl-1-vinyl-2,3-dihydro-1h-pyrazole
CID 129741426
2,5-Dimethyl-1,5-dihydropyrazole
CID 21900373
5-Ethyl-2-methyl-1,5-dihydropyrazole
CID 69932653
2,3-Dimethyl-1,3-dihydropyrazole
CID 70534479
(1E,3R)-2-methyl-1-[methyl(methylamino)amino]penta-1,4-dien-3-amine
CID 88268762
2-Methyl-5-propan-2-yl-1,5-dihydropyrazole
CID 123469879
2-methyl-1-[(2S)-3-methylbutan-2-yl]-1-[(Z)-prop-1-enyl]hydrazine
CID 130415008
3-Ethenyl-2-methyl-1,3-dihydropyrazole
CID 134315486
3-propan-2-yl-2,3-dihydro-1H-pyrazole
CID 135141463
5-Butan-2-yl-3-propan-2-yl-1,2-dihydrotriazole
CID 137384590
(Z)-1-[ethylamino(propan-2-yl)amino]-3-methylbut-1-en-2-amine
CID 139505096

Frequently Asked Questions

What is the IUPAC name of 2,5-di(propan-2-yl)-1,5-dihydropyrazole?
The IUPAC name of 2,5-di(propan-2-yl)-1,5-dihydropyrazole (CID 162502737) is 2,5-di(propan-2-yl)-1,5-dihydropyrazole.
What is the SMILES notation for 2,5-di(propan-2-yl)-1,5-dihydropyrazole?
The canonical SMILES for 2,5-di(propan-2-yl)-1,5-dihydropyrazole is CC(C)C1C=CN(C(C)C)N1.
What is the InChIKey of 2,5-di(propan-2-yl)-1,5-dihydropyrazole?
The InChIKey is UYJRPOHJXBJRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-7(2)9-5-6-11(10-9)8(3)4/h5-10H,1-4H3.
What are the key properties of 2,5-di(propan-2-yl)-1,5-dihydropyrazole?
2,5-di(propan-2-yl)-1,5-dihydropyrazole has a molecular weight of 154.26 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-di(propan-2-yl)-1,5-dihydropyrazole is sourced from PubChem (CID 162502737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).