N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine

C9H16N2S — CID 164663998

IUPACN,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine
SMILESCNC(C)(C)Cc1scnc1C
InChIInChI=1S/C9H16N2S/c1-7-8(12-6-11-7)5-9(2,3)10-4/h6,10H,5H2,1-4H3
InChIKeyPJSKWOIPQZUDBA-UHFFFAOYSA-N
MW184.31 g/mol
LogP1.99
Rot. Bonds3

About N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine

N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine (PubChem CID 164663998) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine
PubChem CID164663998
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC NameN,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine
SMILESCNC(C)(C)Cc1scnc1C
InChIInChI=1S/C9H16N2S/c1-7-8(12-6-11-7)5-9(2,3)10-4/h6,10H,5H2,1-4H3
InChIKeyPJSKWOIPQZUDBA-UHFFFAOYSA-N
XLogP1.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2,2-trimethyl-4-(4-methyl-1,3-thiazol-5-yl)butan-1-amine
CID 62726130
3-methyl-3-[(4-methyl-1,3-thiazol-5-yl)methylamino]butan-1-ol
CID 115655890
2-methyl-4-(4-methyl-1,3-thiazol-5-yl)butan-2-amine
CID 65015632
5-(2,2-dimethylpropyl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1,3,4-oxadiazol-2-amine
CID 75498297
2-ethyl-N,2-dimethyl-4-(4-methyl-1,3-thiazol-5-yl)butan-1-amine
CID 62724465
2,2-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 63373273
2,2,3-trimethyl-1-N-[(4-methyl-1,3-thiazol-5-yl)methyl]butane-1,3-diamine
CID 65267138
(2S)-3-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]butan-2-amine
CID 95377617
3-methyl-3-[(4-methyl-1,3-thiazol-5-yl)methylamino]butanamide
CID 106096010
2,3-dimethyl-3-[2-(4-methyl-1,3-thiazol-5-yl)ethylamino]butan-2-ol
CID 103993489
N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1H-imidazol-2-amine
CID 106572943
5-(2-iodoethyl)-4-methyl-1,3-thiazole
CID 3031968

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine?
The IUPAC name of N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine (CID 164663998) is N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine.
What is the SMILES notation for N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine?
The canonical SMILES for N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine is CNC(C)(C)Cc1scnc1C.
What is the InChIKey of N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine?
The InChIKey is PJSKWOIPQZUDBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-7-8(12-6-11-7)5-9(2,3)10-4/h6,10H,5H2,1-4H3.
What are the key properties of N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine?
N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine has a molecular weight of 184.31 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1-(4-methyl-1,3-thiazol-5-yl)propan-2-amine is sourced from PubChem (CID 164663998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).