5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide

C11H18N4O2 — CID 64600483

IUPAC5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide
SMILESCOCCC(C)Nc1ncc(N)cc1C(N)=O
InChIInChI=1S/C11H18N4O2/c1-7(3-4-17-2)15-11-9(10(13)16)5-8(12)6-14-11/h5-7H,3-4,12H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyUUXKWULASGOTNQ-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.60
Rot. Bonds6

About 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide

5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide (PubChem CID 64600483) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide
PubChem CID64600483
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide
SMILESCOCCC(C)Nc1ncc(N)cc1C(N)=O
InChIInChI=1S/C11H18N4O2/c1-7(3-4-17-2)15-11-9(10(13)16)5-8(12)6-14-11/h5-7H,3-4,12H2,1-2H3,(H2,13,16)(H,14,15)
InChIKeyUUXKWULASGOTNQ-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-2-(4-hydroxybutan-2-ylamino)pyridine-3-carboxamide
CID 83177593
5-amino-2-[(1-methoxy-3-methylbutan-2-yl)amino]pyridine-3-carboxamide
CID 65049915
methyl 5-amino-2-[(4-amino-4-oxobutan-2-yl)amino]pyridine-3-carboxylate
CID 114047408
5-amino-6-(4-methoxybutan-2-ylamino)pyridine-3-carboxylic acid
CID 81438845
5-amino-2-[[1-(dimethylamino)-1-oxopropan-2-yl]amino]pyridine-3-carboxamide
CID 54950472
5-amino-2-(1-imidazol-1-ylpropan-2-ylamino)pyridine-3-carboxamide
CID 61479644
5-amino-2-(ethylamino)pyridine-3-carboxamide
CID 61357419
5-amino-6-(4-methoxybutan-2-ylamino)pyridine-2-carboxamide
CID 114406795
5-amino-2-[2-methoxyethyl(propan-2-yl)amino]pyridine-3-carboxamide
CID 82948360
5-amino-2-[(3-amino-2-hydroxy-3-oxopropyl)amino]pyridine-3-carboxamide
CID 106166474
5-amino-2-(4-ethylsulfanylbutan-2-ylamino)pyridine-3-carboxylic acid
CID 114047418
5-amino-2-(1-pyridin-2-ylethylamino)pyridine-3-carboxamide
CID 61360352

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide (CID 64600483) is 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide is COCCC(C)Nc1ncc(N)cc1C(N)=O.
What is the InChIKey of 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide?
The InChIKey is UUXKWULASGOTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-7(3-4-17-2)15-11-9(10(13)16)5-8(12)6-14-11/h5-7H,3-4,12H2,1-2H3,(H2,13,16)(H,14,15).
What are the key properties of 5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide?
5-amino-2-(4-methoxybutan-2-ylamino)pyridine-3-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-2-(4-methoxybutan-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 64600483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).