2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide

C10H17N3OS — CID 119822762

IUPAC2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
SMILESCCC(C)C(N)C(=O)/N=c1\sccn1C
InChIInChI=1S/C10H17N3OS/c1-4-7(2)8(11)9(14)12-10-13(3)5-6-15-10/h5-8H,4,11H2,1-3H3/b12-10-
InChIKeyKXTBNAMNYHSFFC-BENRWUELSA-N
MW227.33 g/mol
LogP0.89
Rot. Bonds3

About 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide

2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide (PubChem CID 119822762) has the molecular formula C10H17N3OS and a molecular weight of 227.33 g/mol. Its IUPAC name is 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide.

Molecular Properties

Compound Name2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
PubChem CID119822762
Molecular FormulaC10H17N3OS
Molecular Weight227.33 g/mol
Exact Mass227.11
IUPAC Name2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
SMILESCCC(C)C(N)C(=O)/N=c1\sccn1C
InChIInChI=1S/C10H17N3OS/c1-4-7(2)8(11)9(14)12-10-13(3)5-6-15-10/h5-8H,4,11H2,1-3H3/b12-10-
InChIKeyKXTBNAMNYHSFFC-BENRWUELSA-N
XLogP0.89
TPSA60.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3S)-2-amino-3-methyl-1-(2H-1,3-thiazol-3-yl)pentan-1-one
CID 141118334
(2R)-2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 52893975
(2S)-2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 52893976
2-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 53531972
2-(methanesulfonamido)-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 53607507
(2S,3R)-2-(methanesulfonamido)-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 95330099
(2S,3S)-2-(methanesulfonamido)-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 95330100
(2R,3R)-2-(methanesulfonamido)-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 95330101
(2R,3S)-2-(methanesulfonamido)-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 95330102
4-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide
CID 112794692
1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide;hydrochloride
CID 119345920
1-amino-N-(3-methyl-1,3-thiazol-2-ylidene)cyclopentane-1-carboxamide
CID 119345921

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
The IUPAC name of 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide (CID 119822762) is 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide.
What is the SMILES notation for 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
The canonical SMILES for 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide is CCC(C)C(N)C(=O)/N=c1\sccn1C.
What is the InChIKey of 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
The InChIKey is KXTBNAMNYHSFFC-BENRWUELSA-N. The full InChI is InChI=1S/C10H17N3OS/c1-4-7(2)8(11)9(14)12-10-13(3)5-6-15-10/h5-8H,4,11H2,1-3H3/b12-10-.
What are the key properties of 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide?
2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide has a molecular weight of 227.33 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-N-(3-methyl-1,3-thiazol-2-ylidene)pentanamide is sourced from PubChem (CID 119822762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).