2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide

C12H19N5O2 — CID 114195291

IUPAC2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide
SMILESCC(C)(C)NC(=O)CNc1cnc(N)cc1C(N)=O
InChIInChI=1S/C12H19N5O2/c1-12(2,3)17-10(18)6-15-8-5-16-9(13)4-7(8)11(14)19/h4-5,15H,6H2,1-3H3,(H2,13,16)(H2,14,19)(H,17,18)
InChIKeyCYNVMHLGQQKGKX-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.09
Rot. Bonds4

About 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide

2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide (PubChem CID 114195291) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide
PubChem CID114195291
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide
SMILESCC(C)(C)NC(=O)CNc1cnc(N)cc1C(N)=O
InChIInChI=1S/C12H19N5O2/c1-12(2,3)17-10(18)6-15-8-5-16-9(13)4-7(8)11(14)19/h4-5,15H,6H2,1-3H3,(H2,13,16)(H2,14,19)(H,17,18)
InChIKeyCYNVMHLGQQKGKX-UHFFFAOYSA-N
XLogP0.09
TPSA123.13 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[2-(tert-butylamino)-2-oxoethyl]-5-chloropyridine-4-carboxamide
CID 114924235
2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]benzamide
CID 115357122
2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide
CID 114195265
2-amino-5-[(1-methylpiperidin-4-yl)methylamino]pyridine-4-carboxamide
CID 114195011
2-amino-5-[(2-bromophenyl)methylamino]pyridine-4-carboxamide
CID 114194887
N-tert-butyl-2-(4-carbamothioyl-2-fluoroanilino)acetamide
CID 115356360
2-amino-5-[(4-methyl-3-pyridinyl)amino]pyridine-4-carboxamide
CID 114195109
2-amino-5-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyridine-4-carboxylic acid
CID 114195336
2-[(5-amino-3-pyridinyl)amino]-N-tert-butylacetamide
CID 104535517
2-amino-5-(5-iodo-2-methylanilino)pyridine-4-carboxamide
CID 114257930
N-tert-butyl-2-(4-carbamothioyl-2,3-difluoroanilino)acetamide
CID 107935158
2-[(3-amino-5-bromo-2-pyridinyl)amino]-N-tert-butylacetamide
CID 113293132

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide (CID 114195291) is 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide is CC(C)(C)NC(=O)CNc1cnc(N)cc1C(N)=O.
What is the InChIKey of 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide?
The InChIKey is CYNVMHLGQQKGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-12(2,3)17-10(18)6-15-8-5-16-9(13)4-7(8)11(14)19/h4-5,15H,6H2,1-3H3,(H2,13,16)(H2,14,19)(H,17,18).
What are the key properties of 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide?
2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 0.09, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide is sourced from PubChem (CID 114195291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).