N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide

C14H22N2O2S — CID 35362501

IUPACN-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide
SMILESCC(C)CN1CCO[C@@H](CNC(=O)c2cccs2)C1
InChIInChI=1S/C14H22N2O2S/c1-11(2)9-16-5-6-18-12(10-16)8-15-14(17)13-4-3-7-19-13/h3-4,7,11-12H,5-6,8-10H2,1-2H3,(H,15,17)/t12-/m0/s1
InChIKeyMLAQLMWEKPAXDD-LBPRGKRZSA-N
MW282.41 g/mol
LogP1.83
Rot. Bonds5

About N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide

N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide (PubChem CID 35362501) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide
PubChem CID35362501
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide
SMILESCC(C)CN1CCO[C@@H](CNC(=O)c2cccs2)C1
InChIInChI=1S/C14H22N2O2S/c1-11(2)9-16-5-6-18-12(10-16)8-15-14(17)13-4-3-7-19-13/h3-4,7,11-12H,5-6,8-10H2,1-2H3,(H,15,17)/t12-/m0/s1
InChIKeyMLAQLMWEKPAXDD-LBPRGKRZSA-N
XLogP1.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[2-[[4-(2-methylpropyl)morpholin-2-yl]methylamino]-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 55453096
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-4-(thiophen-2-ylsulfonylamino)benzamide
CID 24560165
2,6-difluoro-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 39485652
N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]-1H-indazole-3-carboxamide
CID 30538306
4-acetamido-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 17479762
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 30538422
N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]-4-oxo-3H-phthalazine-1-carboxamide
CID 94014996
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
CID 42919476
N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]-2,2-diphenylacetamide
CID 7995361
3-cyano-N-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methyl]benzamide
CID 35361039
1-methyl-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]indole-3-carboxamide
CID 46576275
N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 24642400

Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide?
The IUPAC name of N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide (CID 35362501) is N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide?
The canonical SMILES for N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide is CC(C)CN1CCO[C@@H](CNC(=O)c2cccs2)C1.
What is the InChIKey of N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide?
The InChIKey is MLAQLMWEKPAXDD-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-11(2)9-16-5-6-18-12(10-16)8-15-14(17)13-4-3-7-19-13/h3-4,7,11-12H,5-6,8-10H2,1-2H3,(H,15,17)/t12-/m0/s1.
What are the key properties of N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide?
N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide has a molecular weight of 282.41 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methyl]thiophene-2-carboxamide is sourced from PubChem (CID 35362501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).