N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine

C13H22N4 — CID 106896358

IUPACN-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine
SMILESCCNC1CCN(Cc2cccnn2)C(C)C1
InChIInChI=1S/C13H22N4/c1-3-14-12-6-8-17(11(2)9-12)10-13-5-4-7-15-16-13/h4-5,7,11-12,14H,3,6,8-10H2,1-2H3
InChIKeyHNWVPOZFPDEUMP-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.44
Rot. Bonds4

About N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine

N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine (PubChem CID 106896358) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine
PubChem CID106896358
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC NameN-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine
SMILESCCNC1CCN(Cc2cccnn2)C(C)C1
InChIInChI=1S/C13H22N4/c1-3-14-12-6-8-17(11(2)9-12)10-13-5-4-7-15-16-13/h4-5,7,11-12,14H,3,6,8-10H2,1-2H3
InChIKeyHNWVPOZFPDEUMP-UHFFFAOYSA-N
XLogP1.44
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-methyl-1-(1,2-oxazol-3-ylmethyl)piperidin-4-amine
CID 81177465
N-ethyl-3-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine
CID 106896343
N-ethyl-2-methyl-1-(thiophen-3-ylmethyl)piperidin-4-amine
CID 63248087
3-[[(2R)-2-methylpiperazin-1-yl]methyl]pyridazine;hydrochloride
CID 171779742
3-[(2-methylpiperazin-1-yl)methyl]pyridazine;hydrochloride
CID 171779875
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-ethyl-2-methylpiperidin-4-amine
CID 79242411
N-ethyl-2-methyl-1-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 114127659
2-methyl-1-[(3-methyl-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
CID 63306392
N-propyl-8-(pyridazin-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 106897823
N,1-dibenzyl-2-methylpiperidin-4-amine
CID 119029011
3,4-dimethyl-N-(pyridazin-3-ylmethyl)cyclohexan-1-amine
CID 106833983
N-ethyl-2-methyl-1-[2-(1,3-thiazol-4-yl)ethyl]piperidin-4-amine
CID 63830814

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine?
The IUPAC name of N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine (CID 106896358) is N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine is CCNC1CCN(Cc2cccnn2)C(C)C1.
What is the InChIKey of N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine?
The InChIKey is HNWVPOZFPDEUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-3-14-12-6-8-17(11(2)9-12)10-13-5-4-7-15-16-13/h4-5,7,11-12,14H,3,6,8-10H2,1-2H3.
What are the key properties of N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine?
N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine has a molecular weight of 234.35 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-1-(pyridazin-3-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 106896358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).