N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane

C12H18N4 — CID 168962388

IUPACN-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane
SMILESCC.Cc1cnn2cc(NC3CC3)cnc12
InChIInChI=1S/C10H12N4.C2H6/c1-7-4-12-14-6-9(5-11-10(7)14)13-8-2-3-8;1-2/h4-6,8,13H,2-3H2,1H3;1-2H3
InChIKeyYMRSWFOUKYOOJA-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.64
Rot. Bonds2

About N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane

N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane (PubChem CID 168962388) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane.

Molecular Properties

Compound NameN-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane
PubChem CID168962388
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC NameN-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane
SMILESCC.Cc1cnn2cc(NC3CC3)cnc12
InChIInChI=1S/C10H12N4.C2H6/c1-7-4-12-14-6-9(5-11-10(7)14)13-8-2-3-8;1-2/h4-6,8,13H,2-3H2,1H3;1-2H3
InChIKeyYMRSWFOUKYOOJA-UHFFFAOYSA-N
XLogP2.64
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane?
The IUPAC name of N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane (CID 168962388) is N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane.
What is the SMILES notation for N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane?
The canonical SMILES for N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane is CC.Cc1cnn2cc(NC3CC3)cnc12.
What is the InChIKey of N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane?
The InChIKey is YMRSWFOUKYOOJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4.C2H6/c1-7-4-12-14-6-9(5-11-10(7)14)13-8-2-3-8;1-2/h4-6,8,13H,2-3H2,1H3;1-2H3.
What are the key properties of N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane?
N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane has a molecular weight of 218.30 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-methylpyrazolo[1,5-a]pyrimidin-6-amine;ethane is sourced from PubChem (CID 168962388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).