5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide

C10H17N5O3S — CID 106333765

IUPAC5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide
SMILESCS(=O)(=O)NCCCNc1ncc(N)cc1C(N)=O
InChIInChI=1S/C10H17N5O3S/c1-19(17,18)15-4-2-3-13-10-8(9(12)16)5-7(11)6-14-10/h5-6,15H,2-4,11H2,1H3,(H2,12,16)(H,13,14)
InChIKeyXWTVXSFRQFNVJV-UHFFFAOYSA-N
MW287.34 g/mol
LogP-0.89
Rot. Bonds7

About 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide

5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide (PubChem CID 106333765) has the molecular formula C10H17N5O3S and a molecular weight of 287.34 g/mol. Its IUPAC name is 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide
PubChem CID106333765
Molecular FormulaC10H17N5O3S
Molecular Weight287.34 g/mol
Exact Mass287.11
IUPAC Name5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide
SMILESCS(=O)(=O)NCCCNc1ncc(N)cc1C(N)=O
InChIInChI=1S/C10H17N5O3S/c1-19(17,18)15-4-2-3-13-10-8(9(12)16)5-7(11)6-14-10/h5-6,15H,2-4,11H2,1H3,(H2,12,16)(H,13,14)
InChIKeyXWTVXSFRQFNVJV-UHFFFAOYSA-N
XLogP-0.89
TPSA140.20 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 5-0.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-4-carboxamide
CID 106341882
5-amino-2-(ethylamino)pyridine-3-carboxamide
CID 61357419
5-amino-2-[3-(3,5-dimethylpyrazol-1-yl)propylamino]pyridine-3-carboxamide
CID 114536234
5-amino-2-chloro-N-[3-(methanesulfonamido)propyl]pyridine-3-carboxamide
CID 106332653
5-amino-2-(3-imidazol-1-ylpropylamino)pyridine-3-carboxamide
CID 61357424
5-amino-2-[2-(3-hydroxypropylsulfanyl)ethylamino]pyridine-3-carboxamide
CID 106309000
N-[2-[(5-amino-3-bromo-2-pyridinyl)amino]ethyl]methanesulfonamide
CID 79532367
N-[3-[(5-amino-3-pyridinyl)amino]propyl]methanesulfonamide
CID 106332321
5-amino-2-(octylamino)pyridine-3-carboxylic acid
CID 114047314
5-amino-2-[(3-amino-2-hydroxy-3-oxopropyl)amino]pyridine-3-carboxamide
CID 106166474
N-[3-[(3-bromo-5-methyl-2-pyridinyl)amino]propyl]methanesulfonamide
CID 102677386
5-amino-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]pyridine-3-carboxamide
CID 79385386

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide (CID 106333765) is 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide is CS(=O)(=O)NCCCNc1ncc(N)cc1C(N)=O.
What is the InChIKey of 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide?
The InChIKey is XWTVXSFRQFNVJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O3S/c1-19(17,18)15-4-2-3-13-10-8(9(12)16)5-7(11)6-14-10/h5-6,15H,2-4,11H2,1H3,(H2,12,16)(H,13,14).
What are the key properties of 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide?
5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide has a molecular weight of 287.34 g/mol, XLogP of -0.89, 7 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[3-(methanesulfonamido)propylamino]pyridine-3-carboxamide is sourced from PubChem (CID 106333765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).