ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine

C15H21N7 — CID 143441754

IUPACethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC.Nc1cc(C2CCNC2)nc2c(-c3cn[nH]c3)cnn12
InChIInChI=1S/C13H15N7.C2H6/c14-12-3-11(8-1-2-15-4-8)19-13-10(7-18-20(12)13)9-5-16-17-6-9;1-2/h3,5-8,15H,1-2,4,14H2,(H,16,17);1-2H3
InChIKeyQIEZIOBMIQMCMS-UHFFFAOYSA-N
MW299.38 g/mol
LogP1.80
Rot. Bonds2

About ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine

ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 143441754) has the molecular formula C15H21N7 and a molecular weight of 299.38 g/mol. Its IUPAC name is ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Nameethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID143441754
Molecular FormulaC15H21N7
Molecular Weight299.38 g/mol
Exact Mass299.19
IUPAC Nameethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC.Nc1cc(C2CCNC2)nc2c(-c3cn[nH]c3)cnn12
InChIInChI=1S/C13H15N7.C2H6/c14-12-3-11(8-1-2-15-4-8)19-13-10(7-18-20(12)13)9-5-16-17-6-9;1-2/h3,5-8,15H,1-2,4,14H2,(H,16,17);1-2H3
InChIKeyQIEZIOBMIQMCMS-UHFFFAOYSA-N
XLogP1.80
TPSA96.92 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

5-piperazin-2-yl-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 71108858
5-(1,1-dioxo-1,4-thiazinan-2-yl)-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 71199014
N-benzyl-5-piperidin-3-yl-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 71011382
5-piperidin-3-yl-3-pyrazin-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 53326009
5-(3-aminopropyl)-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 71108507
5-[1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperidin-3-yl]-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine;3-(1-methylpyrazol-4-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 160637867
tert-butyl (2S,5S)-5-[7-amino-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]-2-[(3-ethoxy-3-oxopropyl)carbamoyl]piperidine-1-carboxylate
CID 71108431
7-amino-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidine-3-carbaldehyde
CID 118131964
5-[(3S,6S)-6-(methoxymethyl)piperidin-3-yl]-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 24821630
5-(3-aminocyclohexyl)-6-bromo-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 78010982
6-bromo-5-piperidin-2-yl-3-(1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 71108599
(NE)-N-[1-[(2S,5S)-5-[7-amino-3-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-2-yl]ethylidene]hydroxylamine
CID 24821564

Frequently Asked Questions

What is the IUPAC name of ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine (CID 143441754) is ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine is CC.Nc1cc(C2CCNC2)nc2c(-c3cn[nH]c3)cnn12.
What is the InChIKey of ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is QIEZIOBMIQMCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N7.C2H6/c14-12-3-11(8-1-2-15-4-8)19-13-10(7-18-20(12)13)9-5-16-17-6-9;1-2/h3,5-8,15H,1-2,4,14H2,(H,16,17);1-2H3.
What are the key properties of ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine?
ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 299.38 g/mol, XLogP of 1.80, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(1H-pyrazol-4-yl)-5-pyrrolidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 143441754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).