N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine

C11H17N5 — CID 71461498

IUPACN',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
SMILESCc1cc(NCCN(C)C)n2nccc2n1
InChIInChI=1S/C11H17N5/c1-9-8-11(12-6-7-15(2)3)16-10(14-9)4-5-13-16/h4-5,8,12H,6-7H2,1-3H3
InChIKeyLJNBXWGNBJWGID-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.01
Rot. Bonds4

About N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine

N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine (PubChem CID 71461498) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
PubChem CID71461498
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
SMILESCc1cc(NCCN(C)C)n2nccc2n1
InChIInChI=1S/C11H17N5/c1-9-8-11(12-6-7-15(2)3)16-10(14-9)4-5-13-16/h4-5,8,12H,6-7H2,1-3H3
InChIKeyLJNBXWGNBJWGID-UHFFFAOYSA-N
XLogP1.01
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine (CID 71461498) is N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine is Cc1cc(NCCN(C)C)n2nccc2n1.
What is the InChIKey of N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine?
The InChIKey is LJNBXWGNBJWGID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-9-8-11(12-6-7-15(2)3)16-10(14-9)4-5-13-16/h4-5,8,12H,6-7H2,1-3H3.
What are the key properties of N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine?
N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine has a molecular weight of 219.29 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-N-(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine is sourced from PubChem (CID 71461498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).