5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide

C11H17N5O2 — CID 114090087

IUPAC5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide
SMILESCN(C)C(=O)CN(C)c1cc(C(N)=O)c(N)cn1
InChIInChI=1S/C11H17N5O2/c1-15(2)10(17)6-16(3)9-4-7(11(13)18)8(12)5-14-9/h4-5H,6,12H2,1-3H3,(H2,13,18)
InChIKeyKXXKHZFFTTZDRL-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.71
Rot. Bonds4

About 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide

5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide (PubChem CID 114090087) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide
PubChem CID114090087
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide
SMILESCN(C)C(=O)CN(C)c1cc(C(N)=O)c(N)cn1
InChIInChI=1S/C11H17N5O2/c1-15(2)10(17)6-16(3)9-4-7(11(13)18)8(12)5-14-9/h4-5H,6,12H2,1-3H3,(H2,13,18)
InChIKeyKXXKHZFFTTZDRL-UHFFFAOYSA-N
XLogP-0.71
TPSA105.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-2-[methyl(2-thiophen-2-ylethyl)amino]pyridine-4-carboxamide
CID 114090453
2-[(5-carbamothioyl-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
CID 43375361
5-amino-2-[2-(dimethylamino)ethyl-propylamino]pyridine-4-carboxamide
CID 114090298
methyl 5-amino-2-[2-(dimethylamino)ethyl-methylamino]pyridine-4-carboxylate
CID 114090370
5-amino-2-[(2-hydroxycyclohexyl)-methylamino]pyridine-4-carboxamide
CID 114090686
2-[(4-amino-6-chloro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
CID 104918783
ethyl 5-amino-2-[methyl(pentyl)amino]pyridine-4-carboxylate
CID 114090078
2-[(5-amino-4-methyl-2-pyridinyl)-propylamino]-N,N-dimethylacetamide
CID 79177065
2-[(6-amino-2-methylsulfanylpyrimidin-4-yl)-methylamino]-N,N-dimethylacetamide
CID 80778671
5-amino-2-[2-cyanoethyl(2-methoxyethyl)amino]pyridine-4-carboxamide
CID 114090352
5-chloro-2-[[2-(diethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxylic acid
CID 114919354
2-[(5-amino-6-methoxy-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
CID 43374936

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide?
The IUPAC name of 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide (CID 114090087) is 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide.
What is the SMILES notation for 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide?
The canonical SMILES for 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide is CN(C)C(=O)CN(C)c1cc(C(N)=O)c(N)cn1.
What is the InChIKey of 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide?
The InChIKey is KXXKHZFFTTZDRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-15(2)10(17)6-16(3)9-4-7(11(13)18)8(12)5-14-9/h4-5H,6,12H2,1-3H3,(H2,13,18).
What are the key properties of 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide?
5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]pyridine-4-carboxamide is sourced from PubChem (CID 114090087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).