1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine

C11H18N4 — CID 106895080

IUPAC1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine
SMILESc1cnnc(CNCC2CCCNC2)c1
InChIInChI=1S/C11H18N4/c1-3-10(7-12-5-1)8-13-9-11-4-2-6-14-15-11/h2,4,6,10,12-13H,1,3,5,7-9H2
InChIKeyATSYHERCDDTYCB-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.57
Rot. Bonds4

About 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine

1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine (PubChem CID 106895080) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine.

Molecular Properties

Compound Name1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine
PubChem CID106895080
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine
SMILESc1cnnc(CNCC2CCCNC2)c1
InChIInChI=1S/C11H18N4/c1-3-10(7-12-5-1)8-13-9-11-4-2-6-14-15-11/h2,4,6,10,12-13H,1,3,5,7-9H2
InChIKeyATSYHERCDDTYCB-UHFFFAOYSA-N
XLogP0.57
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-N-(pyridazin-3-ylmethyl)piperidine-3-carboxamide
CID 106896121
N-[(2-methylpyrazol-3-yl)methyl]-1-piperidin-3-ylmethanamine
CID 80554998
N-[(3-methyl-4-pyridinyl)methyl]-1-piperidin-3-ylmethanamine
CID 114698820
3-(2-piperidin-3-ylethoxy)pyridazine
CID 62483890
N-[(3-chlorophenyl)methyl]-1-[(3S)-piperidin-3-yl]methanamine
CID 95731896
1-(1-methylpiperidin-2-yl)-N-(pyridazin-3-ylmethyl)methanamine
CID 106895129
3-[(piperidin-3-ylmethylamino)methyl]benzamide
CID 80553685
N-(1,3-benzothiazol-2-ylmethyl)-1-piperidin-3-ylmethanamine
CID 80553613
N-[(6-chloro-3-pyridinyl)methyl]-1-[(3S)-piperidin-3-yl]methanamine
CID 97163567
N-[(6-chloro-3-pyridinyl)methyl]-1-[(3R)-piperidin-3-yl]methanamine
CID 97163566
N-[(4-methoxyphenyl)methyl]-1-piperidin-3-ylmethanamine
CID 80553020
N-(piperidin-3-ylmethyl)quinolin-5-amine
CID 80552964

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine?
The IUPAC name of 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine (CID 106895080) is 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine.
What is the SMILES notation for 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine?
The canonical SMILES for 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine is c1cnnc(CNCC2CCCNC2)c1.
What is the InChIKey of 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine?
The InChIKey is ATSYHERCDDTYCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-3-10(7-12-5-1)8-13-9-11-4-2-6-14-15-11/h2,4,6,10,12-13H,1,3,5,7-9H2.
What are the key properties of 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine?
1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine has a molecular weight of 206.29 g/mol, XLogP of 0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine is sourced from PubChem (CID 106895080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).