N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine

C12H15N5 — CID 116970983

IUPACN-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine
SMILESc1cc(-c2ccc(NC3CCNC3)nn2)c[nH]1
InChIInChI=1S/C12H15N5/c1-2-12(15-10-4-6-14-8-10)17-16-11(1)9-3-5-13-7-9/h1-3,5,7,10,13-14H,4,6,8H2,(H,15,17)
InChIKeyBFYVYILQOJOCJZ-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.25
Rot. Bonds3

About N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine

N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine (PubChem CID 116970983) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine
PubChem CID116970983
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC NameN-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine
SMILESc1cc(-c2ccc(NC3CCNC3)nn2)c[nH]1
InChIInChI=1S/C12H15N5/c1-2-12(15-10-4-6-14-8-10)17-16-11(1)9-3-5-13-7-9/h1-3,5,7,10,13-14H,4,6,8H2,(H,15,17)
InChIKeyBFYVYILQOJOCJZ-UHFFFAOYSA-N
XLogP1.25
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[6-(1H-pyrrol-3-yl)pyridazin-3-yl]amino]cyclohexan-1-ol
CID 116972281
N-(2-pyrrolidin-3-ylethyl)-6-(1H-pyrrol-3-yl)pyridazin-3-amine
CID 116972198
N-pyrrolidin-3-yl-1H-pyrrol-3-amine
CID 115118616
6-methyl-N-[(3R)-pyrrolidin-3-yl]pyridazin-3-amine;hydrochloride
CID 71638623
N-[(3S)-pyrrolidin-3-yl]-5-(1H-pyrrol-3-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine
CID 155466084
6-(5-methylfuran-2-yl)-N-piperidin-4-ylpyridazin-3-amine
CID 116971043
N-(1H-pyrrol-3-yl)piperidin-3-amine
CID 83695048
6-cyclopropyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 83832274
5-(3,4-difluorophenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697923
5-methyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 68833864
5-fluoro-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 58254860
6-chloro-N-pyrrolidin-3-ylpyridin-2-amine
CID 78996740

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine?
The IUPAC name of N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine (CID 116970983) is N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine.
What is the SMILES notation for N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine?
The canonical SMILES for N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine is c1cc(-c2ccc(NC3CCNC3)nn2)c[nH]1.
What is the InChIKey of N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine?
The InChIKey is BFYVYILQOJOCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-2-12(15-10-4-6-14-8-10)17-16-11(1)9-3-5-13-7-9/h1-3,5,7,10,13-14H,4,6,8H2,(H,15,17).
What are the key properties of N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine?
N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine has a molecular weight of 229.29 g/mol, XLogP of 1.25, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-yl-6-(1H-pyrrol-3-yl)pyridazin-3-amine is sourced from PubChem (CID 116970983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).