6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide

C14H21N5O — CID 106643858

IUPAC6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide
SMILESNC(=O)c1ccc(N(CC2CCCNC2)C2CC2)nn1
InChIInChI=1S/C14H21N5O/c15-14(20)12-5-6-13(18-17-12)19(11-3-4-11)9-10-2-1-7-16-8-10/h5-6,10-11,16H,1-4,7-9H2,(H2,15,20)
InChIKeyUQUVYQJLCZYQCY-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.54
Rot. Bonds5

About 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide

6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide (PubChem CID 106643858) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide
PubChem CID106643858
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide
SMILESNC(=O)c1ccc(N(CC2CCCNC2)C2CC2)nn1
InChIInChI=1S/C14H21N5O/c15-14(20)12-5-6-13(18-17-12)19(11-3-4-11)9-10-2-1-7-16-8-10/h5-6,10-11,16H,1-4,7-9H2,(H2,15,20)
InChIKeyUQUVYQJLCZYQCY-UHFFFAOYSA-N
XLogP0.54
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-bromo-2-[cyclopropyl(piperidin-3-ylmethyl)amino]benzamide
CID 106643830
N-cyclopropyl-2-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106643689
2-[cyclopropyl(piperidin-3-ylmethyl)amino]-6-methylpyridine-4-carbonitrile
CID 106643778
4-[piperidin-3-ylmethyl(propyl)amino]pyridine-2-carboxamide
CID 106644188
6-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]pyridazine-3-carboxamide
CID 106621384
6-(piperidin-3-ylmethoxy)pyridine-2-carboxamide
CID 64589412
N-cyclopropyl-4-methyl-5-nitro-N-(piperidin-3-ylmethyl)pyridin-2-amine
CID 106643758
2-[[(3S)-piperidin-3-yl]methyl]benzamide
CID 154457528
N-cyclopropyl-N-(piperidin-3-ylmethyl)quinazolin-4-amine
CID 106643652
6-[ethyl(piperidin-3-yl)amino]pyridine-3-carboxamide
CID 63637691
6-[cyclopropyl(piperidin-3-ylmethyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 106643837
3,5-dichloro-N-cyclopropyl-N-(piperidin-3-ylmethyl)benzamide
CID 106628660

Frequently Asked Questions

What is the IUPAC name of 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide?
The IUPAC name of 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide (CID 106643858) is 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide is NC(=O)c1ccc(N(CC2CCCNC2)C2CC2)nn1.
What is the InChIKey of 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide?
The InChIKey is UQUVYQJLCZYQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c15-14(20)12-5-6-13(18-17-12)19(11-3-4-11)9-10-2-1-7-16-8-10/h5-6,10-11,16H,1-4,7-9H2,(H2,15,20).
What are the key properties of 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide?
6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide has a molecular weight of 275.36 g/mol, XLogP of 0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[cyclopropyl(piperidin-3-ylmethyl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 106643858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).