N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine

C13H14N6 — CID 135961528

IUPACN-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine
SMILESc1n[nH]cc1-c1cnc2ccc(NCC3CC3)nn12
InChIInChI=1S/C13H14N6/c1-2-9(1)5-14-12-3-4-13-15-8-11(19(13)18-12)10-6-16-17-7-10/h3-4,6-9H,1-2,5H2,(H,14,18)(H,16,17)
InChIKeyCRYUASUDDBHUSH-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.94
Rot. Bonds4

About N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine

N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine (PubChem CID 135961528) has the molecular formula C13H14N6 and a molecular weight of 254.30 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine
PubChem CID135961528
Molecular FormulaC13H14N6
Molecular Weight254.30 g/mol
Exact Mass254.13
IUPAC NameN-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine
SMILESc1n[nH]cc1-c1cnc2ccc(NCC3CC3)nn12
InChIInChI=1S/C13H14N6/c1-2-9(1)5-14-12-3-4-13-15-8-11(19(13)18-12)10-6-16-17-7-10/h3-4,6-9H,1-2,5H2,(H,14,18)(H,16,17)
InChIKeyCRYUASUDDBHUSH-UHFFFAOYSA-N
XLogP1.94
TPSA70.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine?
The IUPAC name of N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine (CID 135961528) is N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine?
The canonical SMILES for N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine is c1n[nH]cc1-c1cnc2ccc(NCC3CC3)nn12.
What is the InChIKey of N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine?
The InChIKey is CRYUASUDDBHUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6/c1-2-9(1)5-14-12-3-4-13-15-8-11(19(13)18-12)10-6-16-17-7-10/h3-4,6-9H,1-2,5H2,(H,14,18)(H,16,17).
What are the key properties of N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine?
N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine has a molecular weight of 254.30 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-(1H-pyrazol-4-yl)imidazo[1,2-b]pyridazin-6-amine is sourced from PubChem (CID 135961528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).