N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine

C17H21N5 — CID 82270644

IUPACN'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
SMILESCCc1cc(NCCN)n2nc(-c3ccccc3C)cc2n1
InChIInChI=1S/C17H21N5/c1-3-13-10-16(19-9-8-18)22-17(20-13)11-15(21-22)14-7-5-4-6-12(14)2/h4-7,10-11,19H,3,8-9,18H2,1-2H3
InChIKeyUIPJPPVZQYMRTG-UHFFFAOYSA-N
MW295.39 g/mol
LogP2.64
Rot. Bonds5

About N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine

N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine (PubChem CID 82270644) has the molecular formula C17H21N5 and a molecular weight of 295.39 g/mol. Its IUPAC name is N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
PubChem CID82270644
Molecular FormulaC17H21N5
Molecular Weight295.39 g/mol
Exact Mass295.18
IUPAC NameN'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
SMILESCCc1cc(NCCN)n2nc(-c3ccccc3C)cc2n1
InChIInChI=1S/C17H21N5/c1-3-13-10-16(19-9-8-18)22-17(20-13)11-15(21-22)14-7-5-4-6-12(14)2/h4-7,10-11,19H,3,8-9,18H2,1-2H3
InChIKeyUIPJPPVZQYMRTG-UHFFFAOYSA-N
XLogP2.64
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N'-[2-(2-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
CID 82270620
N'-(5-ethyl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)propane-1,3-diamine
CID 82270798
N'-[5-ethyl-2-(oxan-4-yl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
CID 82270640
[2-(2-methoxyphenyl)-5-propylpyrazolo[1,5-a]pyrimidin-7-yl]hydrazine
CID 82270371
N'-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
CID 18406994
N'-(2-cyclohexyl-5-propylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
CID 82270660
N'-[4,6-dimethyl-2-(2-methylphenyl)pyrimidin-5-yl]ethane-1,2-diamine
CID 117212501
N'-[2-(3-fluorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]propane-1,3-diamine
CID 82270770
N'-[5-(2-chlorophenyl)-3-methylpyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine
CID 70806611
3-amino-N-[1-methyl-3-(2-methylphenyl)pyrazol-5-yl]propanamide
CID 119340679
N'-(5-methyl-2-pentan-3-ylpyrazolo[1,5-a]pyrimidin-7-yl)propane-1,3-diamine
CID 82270760
6-ethyl-2-methyl-N-[(1-methyl-3-phenylpyrazol-5-yl)methyl]pyrimidin-4-amine
CID 166363371

Frequently Asked Questions

What is the IUPAC name of N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine?
The IUPAC name of N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine (CID 82270644) is N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine is CCc1cc(NCCN)n2nc(-c3ccccc3C)cc2n1.
What is the InChIKey of N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine?
The InChIKey is UIPJPPVZQYMRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5/c1-3-13-10-16(19-9-8-18)22-17(20-13)11-15(21-22)14-7-5-4-6-12(14)2/h4-7,10-11,19H,3,8-9,18H2,1-2H3.
What are the key properties of N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine?
N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine has a molecular weight of 295.39 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[5-ethyl-2-(2-methylphenyl)pyrazolo[1,5-a]pyrimidin-7-yl]ethane-1,2-diamine is sourced from PubChem (CID 82270644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).