N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine

C12H19N5 — CID 115373053

IUPACN-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
SMILESCCCN(CCNC)c1ccn2nccc2n1
InChIInChI=1S/C12H19N5/c1-3-8-16(10-7-13-2)11-5-9-17-12(15-11)4-6-14-17/h4-6,9,13H,3,7-8,10H2,1-2H3
InChIKeyDCMPKIAUKRXUCQ-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.17
Rot. Bonds6

About N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine

N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine (PubChem CID 115373053) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine.

Molecular Properties

Compound NameN-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
PubChem CID115373053
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC NameN-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
SMILESCCCN(CCNC)c1ccn2nccc2n1
InChIInChI=1S/C12H19N5/c1-3-8-16(10-7-13-2)11-5-9-17-12(15-11)4-6-14-17/h4-6,9,13H,3,7-8,10H2,1-2H3
InChIKeyDCMPKIAUKRXUCQ-UHFFFAOYSA-N
XLogP1.17
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N'-ethyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
CID 115373260
methyl 2-[(2-methoxy-2-oxoethyl)-pyrazolo[1,5-a]pyrimidin-5-ylamino]acetate
CID 115372990
N'-(6-methoxy-2-pyridinyl)-N-methyl-N'-propylethane-1,2-diamine
CID 63587227
N'-ethyl-2-methyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372171
N-[(3-aminophenyl)methyl]-N-ethylpyrazolo[1,5-a]pyrimidin-5-amine
CID 115372842
2-[propan-2-yl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]ethanol
CID 115372880
N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
CID 113296634
N-methyl-N'-propyl-N'-pyrazin-2-ylethane-1,2-diamine
CID 62585682
N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372327
2-[2-[methyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]ethoxy]ethanol
CID 114243521
N',2-dimethyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372172
2-methyl-3-[methyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]propanethioamide
CID 113296606

Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
The IUPAC name of N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine (CID 115373053) is N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine.
What is the SMILES notation for N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
The canonical SMILES for N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine is CCCN(CCNC)c1ccn2nccc2n1.
What is the InChIKey of N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
The InChIKey is DCMPKIAUKRXUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c1-3-8-16(10-7-13-2)11-5-9-17-12(15-11)4-6-14-17/h4-6,9,13H,3,7-8,10H2,1-2H3.
What are the key properties of N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine?
N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine has a molecular weight of 233.32 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-propyl-N'-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine is sourced from PubChem (CID 115373053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).