3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide

C11H16N4O — CID 106896105

IUPAC3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide
SMILESO=C(CCNC1CC1)NCc1cccnn1
InChIInChI=1S/C11H16N4O/c16-11(5-7-12-9-3-4-9)13-8-10-2-1-6-14-15-10/h1-2,6,9,12H,3-5,7-8H2,(H,13,16)
InChIKeyFMCCMSWLCTYLTG-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.23
Rot. Bonds6

About 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide

3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide (PubChem CID 106896105) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide
PubChem CID106896105
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide
SMILESO=C(CCNC1CC1)NCc1cccnn1
InChIInChI=1S/C11H16N4O/c16-11(5-7-12-9-3-4-9)13-8-10-2-1-6-14-15-10/h1-2,6,9,12H,3-5,7-8H2,(H,13,16)
InChIKeyFMCCMSWLCTYLTG-UHFFFAOYSA-N
XLogP0.23
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopropylamino)-N-[(6-methyl-2-pyridinyl)methyl]propanamide
CID 62308912
3-(cycloheptylamino)-N-(pyridin-2-ylmethyl)propanamide
CID 109023192
2-chloro-N-(pyridazin-3-ylmethyl)acetamide
CID 106895472
3-(cyclopentylamino)-N-(pyridin-3-ylmethyl)propanamide
CID 109013619
2-(propylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896058
N-(pyridazin-3-ylmethyl)azetidine-3-carboxamide
CID 106896192
2-(ethylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896183
4-amino-2-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)-1,3-thiazole-5-carboxamide
CID 106898376
3-(cyclopropylamino)-N-[(5-methylthiophen-2-yl)methyl]propanamide
CID 62057057
3-(cyclopropylamino)-N-[[3-(hydroxymethyl)phenyl]methyl]propanamide
CID 107218439
2-(tert-butylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106834522
2-(2-aminophenyl)-N-(pyridazin-3-ylmethyl)acetamide
CID 106894537

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide (CID 106896105) is 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide is O=C(CCNC1CC1)NCc1cccnn1.
What is the InChIKey of 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide?
The InChIKey is FMCCMSWLCTYLTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c16-11(5-7-12-9-3-4-9)13-8-10-2-1-6-14-15-10/h1-2,6,9,12H,3-5,7-8H2,(H,13,16).
What are the key properties of 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide?
3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide has a molecular weight of 220.28 g/mol, XLogP of 0.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-(pyridazin-3-ylmethyl)propanamide is sourced from PubChem (CID 106896105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).