(3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide

C14H23N5O — CID 95841054

IUPAC(3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide
SMILESCN(C)CCNC(=O)[C@@H]1CCCN(c2cccnn2)C1
InChIInChI=1S/C14H23N5O/c1-18(2)10-8-15-14(20)12-5-4-9-19(11-12)13-6-3-7-16-17-13/h3,6-7,12H,4-5,8-11H2,1-2H3,(H,15,20)/t12-/m1/s1
InChIKeyORRCQQAIGGNACT-GFCCVEGCSA-N
MW277.37 g/mol
LogP0.37
Rot. Bonds5

About (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide

(3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide (PubChem CID 95841054) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide
PubChem CID95841054
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name(3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide
SMILESCN(C)CCNC(=O)[C@@H]1CCCN(c2cccnn2)C1
InChIInChI=1S/C14H23N5O/c1-18(2)10-8-15-14(20)12-5-4-9-19(11-12)13-6-3-7-16-17-13/h3,6-7,12H,4-5,8-11H2,1-2H3,(H,15,20)/t12-/m1/s1
InChIKeyORRCQQAIGGNACT-GFCCVEGCSA-N
XLogP0.37
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-pyridazin-3-ylpiperidine-3-carboxamide
CID 110269425
(3S)-1-[6-(4-bromophenyl)sulfanylpyridazin-3-yl]-N-[2-(dimethylamino)ethyl]piperidine-3-carboxamide
CID 95065879
(3S)-1-[1-(3-chlorophenyl)-6-oxopyridazin-3-yl]-N-[2-(dimethylamino)ethyl]piperidine-3-carboxamide
CID 95069692
N-cyclobutyl-1-pyridazin-3-ylpyrrolidine-3-carboxamide
CID 110269436
(3S)-N-[2-(diethylamino)ethyl]-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 94045944
1-(6-methylpyridazin-3-yl)-N-(2-pyrrol-1-ylethyl)piperidine-3-carboxamide
CID 121118673
N-[2-(dimethylamino)ethyl]-1-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidine-3-carboxamide
CID 56716004
(3S)-N-[2-(dimethylamino)ethyl]-1-(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidine-3-carboxamide
CID 95213249
3-amino-N-methyl-N-(1-pyridazin-3-ylpiperidin-3-yl)propanamide;dihydrochloride
CID 119879707
3-[(3,4-dimethylphenyl)methyl]-1-methyl-1-(1-pyridazin-3-ylpiperidin-3-yl)urea
CID 174344195
(3S)-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]-1-pyridin-2-ylpiperidine-3-carboxamide
CID 124839677
N-[3-(N-methylanilino)propyl]-1-[6-(4-methylphenyl)pyridazin-3-yl]piperidine-3-carboxamide
CID 53025081

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide?
The IUPAC name of (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide (CID 95841054) is (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide is CN(C)CCNC(=O)[C@@H]1CCCN(c2cccnn2)C1.
What is the InChIKey of (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide?
The InChIKey is ORRCQQAIGGNACT-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H23N5O/c1-18(2)10-8-15-14(20)12-5-4-9-19(11-12)13-6-3-7-16-17-13/h3,6-7,12H,4-5,8-11H2,1-2H3,(H,15,20)/t12-/m1/s1.
What are the key properties of (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide?
(3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[2-(dimethylamino)ethyl]-1-pyridazin-3-ylpiperidine-3-carboxamide is sourced from PubChem (CID 95841054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).