(2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide

C15H22N4OS — CID 156586201

IUPAC(2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide
SMILESCSC(C)(C)[C@H](N)C(=O)NCc1cn2ccc(C)cc2n1
InChIInChI=1S/C15H22N4OS/c1-10-5-6-19-9-11(18-12(19)7-10)8-17-14(20)13(16)15(2,3)21-4/h5-7,9,13H,8,16H2,1-4H3,(H,17,20)/t13-/m1/s1
InChIKeyJBFUMKWMPOSBDC-CYBMUJFWSA-N
MW306.44 g/mol
LogP1.73
Rot. Bonds5

About (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide

(2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide (PubChem CID 156586201) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide
PubChem CID156586201
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name(2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide
SMILESCSC(C)(C)[C@H](N)C(=O)NCc1cn2ccc(C)cc2n1
InChIInChI=1S/C15H22N4OS/c1-10-5-6-19-9-11(18-12(19)7-10)8-17-14(20)13(16)15(2,3)21-4/h5-7,9,13H,8,16H2,1-4H3,(H,17,20)/t13-/m1/s1
InChIKeyJBFUMKWMPOSBDC-CYBMUJFWSA-N
XLogP1.73
TPSA72.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide with MolForge

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Related Compounds

3-amino-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]butanamide;dihydrochloride
CID 119860092
3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]butanamide
CID 47343605
2-(3-methylbutoxy)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide
CID 51093819
2-methoxy-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 47343610
(2R)-2-amino-3-methyl-N-[(5-methylpyrazin-2-yl)methyl]-3-methylsulfanylbutanamide
CID 157012448
2-[(2-fluorophenyl)sulfonylamino]-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-4-methylsulfanylbutanamide
CID 55977067
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]furan-2-carboxamide
CID 22517208
1-(3,3-diphenylpropyl)-3-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]urea
CID 55909303
4-[4-[(7-methylimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]phenoxy]benzamide
CID 56548828
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-1-propan-2-yl-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 51131057
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]acetamide
CID 90649136
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]propane-1-sulfonamide
CID 22517221

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide?
The IUPAC name of (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide (CID 156586201) is (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide.
What is the SMILES notation for (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide?
The canonical SMILES for (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide is CSC(C)(C)[C@H](N)C(=O)NCc1cn2ccc(C)cc2n1.
What is the InChIKey of (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide?
The InChIKey is JBFUMKWMPOSBDC-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-10-5-6-19-9-11(18-12(19)7-10)8-17-14(20)13(16)15(2,3)21-4/h5-7,9,13H,8,16H2,1-4H3,(H,17,20)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide?
(2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide has a molecular weight of 306.44 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-methyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-methylsulfanylbutanamide is sourced from PubChem (CID 156586201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).