6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide

C10H17N5O2 — CID 106154481

IUPAC6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
SMILESCOCC(CCN)Nc1ccc(C(N)=O)nn1
InChIInChI=1S/C10H17N5O2/c1-17-6-7(4-5-11)13-9-3-2-8(10(12)16)14-15-9/h2-3,7H,4-6,11H2,1H3,(H2,12,16)(H,13,15)
InChIKeyOFZHQRGPHGVSIG-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.65
Rot. Bonds7

About 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide

6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide (PubChem CID 106154481) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
PubChem CID106154481
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
SMILESCOCC(CCN)Nc1ccc(C(N)=O)nn1
InChIInChI=1S/C10H17N5O2/c1-17-6-7(4-5-11)13-9-3-2-8(10(12)16)14-15-9/h2-3,7H,4-6,11H2,1H3,(H2,12,16)(H,13,15)
InChIKeyOFZHQRGPHGVSIG-UHFFFAOYSA-N
XLogP-0.65
TPSA116.15 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-6-[(4-hydroxy-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide
CID 106158242
methyl 6-(1-aminopentan-2-ylamino)pyridazine-3-carboxylate
CID 65192484
6-[1,3-bis(2-fluorophenyl)propan-2-ylamino]pyridazine-3-carboxamide
CID 133398315
6-(hex-1-yn-3-ylamino)pyridazine-3-carboxamide
CID 106231516
6-(4-methylsulfinylbutan-2-ylamino)pyridazine-3-carboxamide
CID 113260885
5-[(5-amino-1-methoxypentan-2-yl)amino]-2-chlorobenzamide
CID 103388414
6-[(1-methoxy-3-methylbutan-2-yl)amino]-N-methylpyridazine-3-carboxamide
CID 79214306
N-(4-amino-1-methoxybutan-2-yl)-2-ethylbenzamide
CID 114150708
4-[(1-amino-3-methoxypropan-2-yl)amino]pyridine-2-carboxamide
CID 106182130
5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide
CID 114406795
N-(4-amino-1-methoxybutan-2-yl)-2-(4-methoxyphenyl)acetamide
CID 106152212
6-[1-(diethylamino)propan-2-ylamino]pyridazine-3-carboxamide
CID 79098153

Frequently Asked Questions

What is the IUPAC name of 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
The IUPAC name of 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide (CID 106154481) is 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide is COCC(CCN)Nc1ccc(C(N)=O)nn1.
What is the InChIKey of 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
The InChIKey is OFZHQRGPHGVSIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-17-6-7(4-5-11)13-9-3-2-8(10(12)16)14-15-9/h2-3,7H,4-6,11H2,1H3,(H2,12,16)(H,13,15).
What are the key properties of 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide?
6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide has a molecular weight of 239.28 g/mol, XLogP of -0.65, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-amino-1-methoxybutan-2-yl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 106154481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).