5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide

C11H18N4O2 — CID 114406795

IUPAC5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide
SMILESCOCCC(C)Nc1nc(C(N)=O)ccc1N
InChIInChI=1S/C11H18N4O2/c1-7(5-6-17-2)14-11-8(12)3-4-9(15-11)10(13)16/h3-4,7H,5-6,12H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyHXHJDVTUMCRYPZ-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.60
Rot. Bonds6

About 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide

5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide (PubChem CID 114406795) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide
PubChem CID114406795
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide
SMILESCOCCC(C)Nc1nc(C(N)=O)ccc1N
InChIInChI=1S/C11H18N4O2/c1-7(5-6-17-2)14-11-8(12)3-4-9(15-11)10(13)16/h3-4,7H,5-6,12H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyHXHJDVTUMCRYPZ-UHFFFAOYSA-N
XLogP0.60
TPSA103.26 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-6-(hexan-2-ylamino)pyridine-2-carboxamide
CID 114406333
5-amino-6-(butan-2-ylamino)pyridine-2-carboxamide
CID 114404937
5-amino-6-(4-methoxybutylamino)pyridine-2-carboxamide
CID 114406169
5-amino-6-(5-methoxypentylamino)pyridine-2-carboxamide
CID 114131934
5-amino-6-(3,3-dimethylbutan-2-ylamino)pyridine-2-carboxamide
CID 114407840
5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide
CID 64600483
5-amino-6-[4-(2-methoxyethoxy)butylamino]pyridine-2-carboxamide
CID 114407848
5-amino-6-[[1-(diethylamino)-1-oxopropan-2-yl]amino]pyridine-2-carboxamide
CID 114407679
methyl 6-(4-methoxybutan-2-ylamino)-5-nitropyridine-2-carboxylate
CID 114404216
5-amino-6-(2-methoxyethoxy)pyridine-2-carboxamide
CID 114408602
methyl 5-amino-6-(1-ethylsulfanylpropan-2-ylamino)pyridine-2-carboxylate
CID 114408015
5-amino-6-(1-phenylpropylamino)pyridine-2-carboxamide
CID 114406353

Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide?
The IUPAC name of 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide (CID 114406795) is 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide is COCCC(C)Nc1nc(C(N)=O)ccc1N.
What is the InChIKey of 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide?
The InChIKey is HXHJDVTUMCRYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-7(5-6-17-2)14-11-8(12)3-4-9(15-11)10(13)16/h3-4,7H,5-6,12H2,1-2H3,(H2,13,16)(H,14,15).
What are the key properties of 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide?
5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 0.60, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide is sourced from PubChem (CID 114406795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).