6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine

C14H18N4O — CID 116971067

IUPAC6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
SMILESCc1ccc(-c2ccc(NCC3CCCN3)nn2)o1
InChIInChI=1S/C14H18N4O/c1-10-4-6-13(19-10)12-5-7-14(18-17-12)16-9-11-3-2-8-15-11/h4-7,11,15H,2-3,8-9H2,1H3,(H,16,18)
InChIKeyYDBIHGRZTJLJDS-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.21
Rot. Bonds4

About 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine

6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine (PubChem CID 116971067) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
PubChem CID116971067
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
SMILESCc1ccc(-c2ccc(NCC3CCCN3)nn2)o1
InChIInChI=1S/C14H18N4O/c1-10-4-6-13(19-10)12-5-7-14(18-17-12)16-9-11-3-2-8-15-11/h4-7,11,15H,2-3,8-9H2,1H3,(H,16,18)
InChIKeyYDBIHGRZTJLJDS-UHFFFAOYSA-N
XLogP2.21
TPSA62.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
CID 83838052
6-(5-methylfuran-2-yl)-N-piperidin-4-ylpyridazin-3-amine
CID 116971043
N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine
CID 116970435
3-methyl-2-[6-[[(2S)-pyrrolidin-2-yl]methylamino]pyridazin-3-yl]-5-(trifluoromethyl)phenol
CID 155284840
3,5-dimethyl-2-[6-[[(2R)-piperidin-2-yl]methylamino]pyridazin-3-yl]phenol
CID 162198494
2-[2-(5-methylfuran-2-yl)propyl]pyrrolidine
CID 83907601
3-methyl-2-[6-[[(2S)-piperidin-2-yl]methylamino]pyridazin-3-yl]-5-(trifluoromethyl)phenol
CID 155284642
5-fluoro-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 62542199
2-methyl-N-(pyrrolidin-2-ylmethyl)pyrazol-3-amine
CID 103542592
5-bromo-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 62542194
6-cyclopentyl-N-(morpholin-3-ylmethyl)pyridazin-3-amine
CID 116972241
2-chloro-6-methyl-N-[[(2R)-pyrrolidin-2-yl]methyl]pyrimidin-4-amine
CID 97162852

Frequently Asked Questions

What is the IUPAC name of 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The IUPAC name of 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine (CID 116971067) is 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The canonical SMILES for 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine is Cc1ccc(-c2ccc(NCC3CCCN3)nn2)o1.
What is the InChIKey of 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The InChIKey is YDBIHGRZTJLJDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10-4-6-13(19-10)12-5-7-14(18-17-12)16-9-11-3-2-8-15-11/h4-7,11,15H,2-3,8-9H2,1H3,(H,16,18).
What are the key properties of 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine has a molecular weight of 258.32 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 116971067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).