(2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide

C15H20N2O5S — CID 124842764

IUPAC(2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
SMILESCc1ccc2c(c1)CC[C@H](C(=O)NCCC(=O)NS(C)(=O)=O)O2
InChIInChI=1S/C15H20N2O5S/c1-10-3-5-12-11(9-10)4-6-13(22-12)15(19)16-8-7-14(18)17-23(2,20)21/h3,5,9,13H,4,6-8H2,1-2H3,(H,16,19)(H,17,18)/t13-/m1/s1
InChIKeyCQURRGFOLARRJD-CYBMUJFWSA-N
MW340.40 g/mol
LogP0.27
Rot. Bonds5

About (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide

(2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide (PubChem CID 124842764) has the molecular formula C15H20N2O5S and a molecular weight of 340.40 g/mol. Its IUPAC name is (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
PubChem CID124842764
Molecular FormulaC15H20N2O5S
Molecular Weight340.40 g/mol
Exact Mass340.11
IUPAC Name(2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
SMILESCc1ccc2c(c1)CC[C@H](C(=O)NCCC(=O)NS(C)(=O)=O)O2
InChIInChI=1S/C15H20N2O5S/c1-10-3-5-12-11(9-10)4-6-13(22-12)15(19)16-8-7-14(18)17-23(2,20)21/h3,5,9,13H,4,6-8H2,1-2H3,(H,16,19)(H,17,18)/t13-/m1/s1
InChIKeyCQURRGFOLARRJD-CYBMUJFWSA-N
XLogP0.27
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide with MolForge

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Related Compounds

(2R)-N-[2-(3-amino-1,2,4-oxadiazol-5-yl)ethyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
CID 129345291
(2S)-6-methyl-3,4-dihydro-2H-chromene-2-carboxylic acid
CID 94865790
N-[[2-(aminomethyl)phenyl]methyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
CID 166298512
ethane;1-(6-methyl-3,4-dihydro-2H-chromen-2-yl)propan-1-one
CID 143613083
N-(4-carbamoylphenyl)-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
CID 139007058
N-(2-aminoethyl)-1-(6-methyl-3,4-dihydro-2H-chromene-2-carbonyl)piperidine-3-carboxamide
CID 154577921
N-(3,5-dimethoxyphenyl)-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
CID 44515635
6-methyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)-3,4-dihydro-2H-chromene-2-carboxamide
CID 126803972
2-[(2R)-6-methyl-3,4-dihydro-2H-chromen-2-yl]acetic acid
CID 147031963
(2R)-7-methyl-5-methylsulfonyl-N-(2-phenylethyl)-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide
CID 98005179
N-(2-cyclobutylpyrazol-3-yl)-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide
CID 136567760
N-[2-(2-methyl-3-pyridinyl)ethyl]-3,4-dihydro-2H-chromene-2-carboxamide
CID 136567978

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide?
The IUPAC name of (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide (CID 124842764) is (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide.
What is the SMILES notation for (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide?
The canonical SMILES for (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide is Cc1ccc2c(c1)CC[C@H](C(=O)NCCC(=O)NS(C)(=O)=O)O2.
What is the InChIKey of (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide?
The InChIKey is CQURRGFOLARRJD-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H20N2O5S/c1-10-3-5-12-11(9-10)4-6-13(22-12)15(19)16-8-7-14(18)17-23(2,20)21/h3,5,9,13H,4,6-8H2,1-2H3,(H,16,19)(H,17,18)/t13-/m1/s1.
What are the key properties of (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide?
(2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide has a molecular weight of 340.40 g/mol, XLogP of 0.27, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[3-(methanesulfonamido)-3-oxopropyl]-6-methyl-3,4-dihydro-2H-chromene-2-carboxamide is sourced from PubChem (CID 124842764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).