6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide

C14H22N6O — CID 80553434

IUPAC6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide
SMILESNC(=O)c1ccc(N2CCC(N3CCC(N)CC3)C2)nn1
InChIInChI=1S/C14H22N6O/c15-10-3-6-19(7-4-10)11-5-8-20(9-11)13-2-1-12(14(16)21)17-18-13/h1-2,10-11H,3-9,15H2,(H2,16,21)
InChIKeyRVMJVWCVNJEKSM-UHFFFAOYSA-N
MW290.37 g/mol
LogP-0.42
Rot. Bonds3

About 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide

6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide (PubChem CID 80553434) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide
PubChem CID80553434
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide
SMILESNC(=O)c1ccc(N2CCC(N3CCC(N)CC3)C2)nn1
InChIInChI=1S/C14H22N6O/c15-10-3-6-19(7-4-10)11-5-8-20(9-11)13-2-1-12(14(16)21)17-18-13/h1-2,10-11H,3-9,15H2,(H2,16,21)
InChIKeyRVMJVWCVNJEKSM-UHFFFAOYSA-N
XLogP-0.42
TPSA101.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(4-aminopiperidin-1-yl)pyridazine-3-carboxylic acid
CID 61402767
6-[(3S)-3-(2-methyl-4,5,6,7-tetrahydrobenzimidazol-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide
CID 129473090
1-[1-(5-nitro-2-pyridinyl)pyrrolidin-3-yl]piperidin-4-amine
CID 80553412
methyl 1-(6-carbamoylpyridazin-3-yl)piperidine-4-carboxylate
CID 79099458
6-[(3aR,7aS)-1,3,3a,4,7,7a-hexahydroisoindol-2-yl]pyridazine-3-carboxamide
CID 95971166
6-[(3aS,7aS)-1,3,3a,4,7,7a-hexahydroisoindol-2-yl]pyridazine-3-carboxamide
CID 95971169
1-(1-pyrimidin-2-ylpyrrolidin-3-yl)piperidin-4-amine
CID 80553075
1-[1-(6-methoxy-2-pyridinyl)pyrrolidin-3-yl]piperidin-4-amine
CID 80553095
6-[4-[(4-propan-2-ylphenyl)methyl]piperidin-1-yl]pyridazine-3-carboxamide
CID 133473201
6-[2-(furan-2-yl)morpholin-4-yl]pyridazine-3-carboxamide
CID 133347306
methyl 6-[3-(aminomethyl)pyrrolidin-1-yl]pyridazine-3-carboxylate
CID 62063099
6-(3-methoxypyrrolidin-1-yl)pyridazine-3-carboxylic acid
CID 103534319

Frequently Asked Questions

What is the IUPAC name of 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide?
The IUPAC name of 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide (CID 80553434) is 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide?
The canonical SMILES for 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide is NC(=O)c1ccc(N2CCC(N3CCC(N)CC3)C2)nn1.
What is the InChIKey of 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide?
The InChIKey is RVMJVWCVNJEKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c15-10-3-6-19(7-4-10)11-5-8-20(9-11)13-2-1-12(14(16)21)17-18-13/h1-2,10-11H,3-9,15H2,(H2,16,21).
What are the key properties of 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide?
6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide has a molecular weight of 290.37 g/mol, XLogP of -0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]pyridazine-3-carboxamide is sourced from PubChem (CID 80553434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).