2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine

C17H21N5 — CID 56898576

IUPAC2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCC(Nc1cc(C)nc2cc(C)nn12)c1cc(C)ccn1
InChIInChI=1S/C17H21N5/c1-5-14(15-8-11(2)6-7-18-15)20-17-9-12(3)19-16-10-13(4)21-22(16)17/h6-10,14,20H,5H2,1-4H3
InChIKeyITFOKGVNFWHMQW-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.61
Rot. Bonds4

About 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine

2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 56898576) has the molecular formula C17H21N5 and a molecular weight of 295.39 g/mol. Its IUPAC name is 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID56898576
Molecular FormulaC17H21N5
Molecular Weight295.39 g/mol
Exact Mass295.18
IUPAC Name2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCC(Nc1cc(C)nc2cc(C)nn12)c1cc(C)ccn1
InChIInChI=1S/C17H21N5/c1-5-14(15-8-11(2)6-7-18-15)20-17-9-12(3)19-16-10-13(4)21-22(16)17/h6-10,14,20H,5H2,1-4H3
InChIKeyITFOKGVNFWHMQW-UHFFFAOYSA-N
XLogP3.61
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethyl-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95872610
N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 95862840
(3R)-3-(4-methylphenyl)-3-[(2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-yl)amino]propan-1-ol
CID 95874013
N-[1-(1H-imidazol-2-yl)propyl]-5-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 129284743
4-[(1R)-1-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]phenol
CID 95867959
N-[(1S)-1-(4-methyl-2-pyridinyl)propyl]-1H-pyrrolo[2,3-b]pyridin-6-amine
CID 95715865
N'-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
CID 18406994
[2-(2-ethyl-5-methylpyrazol-3-yl)-1-(4-methyl-2-pyridinyl)ethyl]hydrazine
CID 105219848
2,3,5-trimethyl-N-[(1R)-1-(2-methylpyrazol-3-yl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 95871017
1-methyl-N-[1-(4-methyl-2-pyridinyl)propyl]-6-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 56891373
N-(2-ethylsulfanylethyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 70759489
2,5-dimethyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 70788936

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine (CID 56898576) is 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine is CCC(Nc1cc(C)nc2cc(C)nn12)c1cc(C)ccn1.
What is the InChIKey of 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is ITFOKGVNFWHMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5/c1-5-14(15-8-11(2)6-7-18-15)20-17-9-12(3)19-16-10-13(4)21-22(16)17/h6-10,14,20H,5H2,1-4H3.
What are the key properties of 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine?
2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 295.39 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[1-(4-methyl-2-pyridinyl)propyl]pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 56898576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).