N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide

C12H20N4O3S — CID 81241660

IUPACN-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)NCC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C12H20N4O3S/c1-12(2,16-20(4,18)19)8-15-11(17)9-7-14-6-5-10(9)13-3/h5-7,16H,8H2,1-4H3,(H,13,14)(H,15,17)
InChIKeyFTFWLCSNVRUAJO-UHFFFAOYSA-N
MW300.38 g/mol
LogP0.18
Rot. Bonds6

About N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide

N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide (PubChem CID 81241660) has the molecular formula C12H20N4O3S and a molecular weight of 300.38 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide
PubChem CID81241660
Molecular FormulaC12H20N4O3S
Molecular Weight300.38 g/mol
Exact Mass300.13
IUPAC NameN-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)NCC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C12H20N4O3S/c1-12(2,16-20(4,18)19)8-15-11(17)9-7-14-6-5-10(9)13-3/h5-7,16H,8H2,1-4H3,(H,13,14)(H,15,17)
InChIKeyFTFWLCSNVRUAJO-UHFFFAOYSA-N
XLogP0.18
TPSA100.19 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-(ethylamino)-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-4-carboxamide
CID 105070214
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-4-(methylamino)pyridine-3-carboxamide
CID 106280202
3-(methylamino)-N-(2-methyl-2-methylsulfonylpropyl)pyridine-4-carboxamide
CID 105070655
N-[3-(methanesulfonamido)propyl]-4-(methylamino)pyridine-3-carboxamide
CID 106342407
3-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]-2-(methylamino)pyridine-4-carboxamide
CID 105386402
4-(methylamino)-N-(3-methylsulfonylpropyl)pyridine-3-carboxamide
CID 81242256
4-(methylamino)-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-3-carboxamide
CID 81245260
N-(2,2-dimethylpropyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81242453
4-(methylamino)-N-(2,4,4-trimethylpentan-2-yl)pyridine-3-carboxamide
CID 81239742
3-chloro-N-[2-(methanesulfonamido)-2-methylpropyl]-6-(methylamino)pyridine-2-carboxamide
CID 63863169
N-(4-amino-2-methyl-4-oxobutan-2-yl)-4-(methylamino)pyridine-3-carboxamide
CID 114143178
N-(2,2-dimethylbutyl)-4-(ethylamino)pyridine-3-carboxamide
CID 103464518

Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide (CID 81241660) is N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide is CNc1ccncc1C(=O)NCC(C)(C)NS(C)(=O)=O.
What is the InChIKey of N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide?
The InChIKey is FTFWLCSNVRUAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3S/c1-12(2,16-20(4,18)19)8-15-11(17)9-7-14-6-5-10(9)13-3/h5-7,16H,8H2,1-4H3,(H,13,14)(H,15,17).
What are the key properties of N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide?
N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide has a molecular weight of 300.38 g/mol, XLogP of 0.18, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)-2-methylpropyl]-4-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81241660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).