3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine

C7H6Cl2N4 — CID 122457230

IUPAC3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCNc1cc(Cl)nc2c(Cl)cnn12
InChIInChI=1S/C7H6Cl2N4/c1-10-6-2-5(9)12-7-4(8)3-11-13(6)7/h2-3,10H,1H3
InChIKeyGBGHUUCOPRVDJH-UHFFFAOYSA-N
MW217.06 g/mol
LogP2.08
Rot. Bonds1

About 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine

3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 122457230) has the molecular formula C7H6Cl2N4 and a molecular weight of 217.06 g/mol. Its IUPAC name is 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID122457230
Molecular FormulaC7H6Cl2N4
Molecular Weight217.06 g/mol
Exact Mass216.00
IUPAC Name3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCNc1cc(Cl)nc2c(Cl)cnn12
InChIInChI=1S/C7H6Cl2N4/c1-10-6-2-5(9)12-7-4(8)3-11-13(6)7/h2-3,10H,1H3
InChIKeyGBGHUUCOPRVDJH-UHFFFAOYSA-N
XLogP2.08
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.06
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3,5-dichloropyrazolo[1,5-a]pyrimidin-7-yl)carbamic acid
CID 175823311
5-chloro-N-(4-methylphenyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 142946922
3-bromo-5-chloro-N-(2-methoxyethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 118452773
3-bromo-5-chloro-N-(4-methylsulfonylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 10046634
3-bromo-5-chloro-N-(3-propylhexyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 90176158
5-chloro-N-(4-methylsulfonylphenyl)-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 23645575
4-[(5-chloro-3-cyclopropylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-N,N-dimethylbenzenesulfinamide
CID 142946934
N-[3-chloro-7-(cyclopentylamino)pyrazolo[1,5-a]pyrimidin-5-yl]acetamide
CID 146558364
5-chloro-3-methylpyrazolo[1,5-a]pyrimidin-7-amine;ethane
CID 142869999
4,6-dichloro-1-methylpyrazolo[5,4-b]pyridine
CID 58083235
CID 142947005
CID 142947005
5-chloro-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethane
CID 145163887

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine (CID 122457230) is 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine is CNc1cc(Cl)nc2c(Cl)cnn12.
What is the InChIKey of 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is GBGHUUCOPRVDJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2N4/c1-10-6-2-5(9)12-7-4(8)3-11-13(6)7/h2-3,10H,1H3.
What are the key properties of 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine?
3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 217.06 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-methylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 122457230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).