(2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide

C10H18N4O3S2 — CID 164637008

IUPAC(2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide
SMILESCOC[C@H]1CCCN1S(=O)(=O)NCc1csc(N)n1
InChIInChI=1S/C10H18N4O3S2/c1-17-6-9-3-2-4-14(9)19(15,16)12-5-8-7-18-10(11)13-8/h7,9,12H,2-6H2,1H3,(H2,11,13)/t9-/m1/s1
InChIKeyLRZMQDQNMQYFBM-SECBINFHSA-N
MW306.41 g/mol
LogP0.17
Rot. Bonds6

About (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide

(2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide (PubChem CID 164637008) has the molecular formula C10H18N4O3S2 and a molecular weight of 306.41 g/mol. Its IUPAC name is (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide
PubChem CID164637008
Molecular FormulaC10H18N4O3S2
Molecular Weight306.41 g/mol
Exact Mass306.08
IUPAC Name(2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide
SMILESCOC[C@H]1CCCN1S(=O)(=O)NCc1csc(N)n1
InChIInChI=1S/C10H18N4O3S2/c1-17-6-9-3-2-4-14(9)19(15,16)12-5-8-7-18-10(11)13-8/h7,9,12H,2-6H2,1H3,(H2,11,13)/t9-/m1/s1
InChIKeyLRZMQDQNMQYFBM-SECBINFHSA-N
XLogP0.17
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide
CID 131924351
N-[(2-amino-1,3-thiazol-4-yl)methyl]-4-(methoxymethyl)piperidine-1-sulfonamide
CID 131940167
3-(methoxymethyl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-1-sulfonamide
CID 131931237
2-(methoxymethyl)-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyrrolidine-1-sulfonamide
CID 131907581
4-[[3-(methoxymethyl)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 106587020
(2R)-2-(methoxymethyl)pyrrolidine-1-sulfonamide
CID 126742603
N-[2-(4,5-dimethylimidazol-1-yl)ethyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide
CID 131912505
[1-[(2-amino-1,3-thiazol-4-yl)methyl]pyrrolidin-2-yl]methanol
CID 126981102
2-(methoxymethyl)-N-[[4-(2-phenylethyl)-1,2,4-triazol-3-yl]methyl]pyrrolidine-1-sulfonamide
CID 131942103
4-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-1,3-thiazol-2-amine
CID 65484861
2-(2-amino-1,3-thiazol-4-yl)-1-[3-(methoxymethyl)piperidin-1-yl]ethanone
CID 106586801
[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]sulfonylcarbamic acid
CID 68551134

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide (CID 164637008) is (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide is COC[C@H]1CCCN1S(=O)(=O)NCc1csc(N)n1.
What is the InChIKey of (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide?
The InChIKey is LRZMQDQNMQYFBM-SECBINFHSA-N. The full InChI is InChI=1S/C10H18N4O3S2/c1-17-6-9-3-2-4-14(9)19(15,16)12-5-8-7-18-10(11)13-8/h7,9,12H,2-6H2,1H3,(H2,11,13)/t9-/m1/s1.
What are the key properties of (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide?
(2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide has a molecular weight of 306.41 g/mol, XLogP of 0.17, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2-amino-1,3-thiazol-4-yl)methyl]-2-(methoxymethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 164637008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).