N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide

C13H21N3O2S — CID 62146200

IUPACN-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)N(C)CC1CC1
InChIInChI=1S/C13H21N3O2S/c1-3-8-14-13-12(5-4-9-15-13)19(17,18)16(2)10-11-6-7-11/h4-5,9,11H,3,6-8,10H2,1-2H3,(H,14,15)
InChIKeyRILYPRQVXYEDRO-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.93
Rot. Bonds7

About N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide

N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide (PubChem CID 62146200) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide
PubChem CID62146200
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide
SMILESCCCNc1ncccc1S(=O)(=O)N(C)CC1CC1
InChIInChI=1S/C13H21N3O2S/c1-3-8-14-13-12(5-4-9-15-13)19(17,18)16(2)10-11-6-7-11/h4-5,9,11H,3,6-8,10H2,1-2H3,(H,14,15)
InChIKeyRILYPRQVXYEDRO-UHFFFAOYSA-N
XLogP1.93
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
CID 62144977
N-cyclopropyl-N-ethyl-2-(propylamino)pyridine-3-sulfonamide
CID 55043917
N-cyclopropyl-N-propyl-2-(propylamino)pyridine-3-sulfonamide
CID 62144651
N-(cyclopropylmethyl)-2-(ethylamino)-N-propan-2-ylpyridine-3-sulfonamide
CID 62152949
N-methyl-N-(4-methylpentan-2-yl)-2-(propylamino)pyridine-3-sulfonamide
CID 62152933
N-(cyclopropylmethyl)-2-(methylamino)-N-propylpyridine-3-sulfonamide
CID 62156926
N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
CID 63940110
N-methyl-2-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-3-sulfonamide
CID 62146077
N-(cyclopentylmethyl)-2-(propylamino)pyridine-3-sulfonamide
CID 62145695
2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide
CID 62151896
3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]sulfonyl-N-propylpyridin-2-amine
CID 104968712
3-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylsulfonyl)-N-propylpyridin-2-amine
CID 115561614

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide (CID 62146200) is N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide is CCCNc1ncccc1S(=O)(=O)N(C)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide?
The InChIKey is RILYPRQVXYEDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-3-8-14-13-12(5-4-9-15-13)19(17,18)16(2)10-11-6-7-11/h4-5,9,11H,3,6-8,10H2,1-2H3,(H,14,15).
What are the key properties of N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide?
N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62146200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).