2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide

C10H16N4O — CID 165466186

IUPAC2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide
SMILESCC(C)NC(=O)C(N)Cc1ccnnc1
InChIInChI=1S/C10H16N4O/c1-7(2)14-10(15)9(11)5-8-3-4-12-13-6-8/h3-4,6-7,9H,5,11H2,1-2H3,(H,14,15)
InChIKeyDQMSJONPGWNLCT-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.13
Rot. Bonds4

About 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide

2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide (PubChem CID 165466186) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide.

Molecular Properties

Compound Name2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide
PubChem CID165466186
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide
SMILESCC(C)NC(=O)C(N)Cc1ccnnc1
InChIInChI=1S/C10H16N4O/c1-7(2)14-10(15)9(11)5-8-3-4-12-13-6-8/h3-4,6-7,9H,5,11H2,1-2H3,(H,14,15)
InChIKeyDQMSJONPGWNLCT-UHFFFAOYSA-N
XLogP-0.13
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-phenyl-N-propan-2-ylpropanamide
CID 15926064
2-amino-4-pyridazin-4-ylbutanoic acid
CID 69404506
2-amino-N-[(1R)-1-cycloheptylethyl]-3-phenylpropanamide
CID 81389396
(2R)-2-amino-N-[(1S)-1-cyclohexylethyl]-3-phenylpropanamide
CID 81386066
2-amino-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]-3-(4-phenylphenyl)propanamide
CID 135306568
(2S)-2-amino-N-(1-cyclobutylethyl)-3-(4-hydroxyphenyl)propanamide
CID 104871348
(2S)-2-amino-N-(1-methylcyclohexyl)-3-pyridin-4-ylpropanamide
CID 138006096
2-amino-4-phenyl-N-propan-2-ylbutanamide
CID 114924577
2-amino-N-ethyl-3-pyridin-3-ylpropanamide
CID 129276971
(2S)-2-N-(pyridazin-4-ylmethyl)propane-1,2-diamine
CID 104867606
2-amino-3-phenyl-N-(1-phenylethyl)propanamide
CID 24709310
(2R)-2-amino-N-butan-2-yl-3-phenylpropanamide
CID 78985447

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide?
The IUPAC name of 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide (CID 165466186) is 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide.
What is the SMILES notation for 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide?
The canonical SMILES for 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide is CC(C)NC(=O)C(N)Cc1ccnnc1.
What is the InChIKey of 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide?
The InChIKey is DQMSJONPGWNLCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7(2)14-10(15)9(11)5-8-3-4-12-13-6-8/h3-4,6-7,9H,5,11H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide?
2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide has a molecular weight of 208.26 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-propan-2-yl-3-pyridazin-4-ylpropanamide is sourced from PubChem (CID 165466186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).