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

C10H18N2S — CID 165376869

IUPACN,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine
SMILESCc1ncc(CN(C)C(C)(C)C)s1
InChIInChI=1S/C10H18N2S/c1-8-11-6-9(13-8)7-12(5)10(2,3)4/h6H,7H2,1-5H3
InChIKeyDSRCMWOGDWNTHD-UHFFFAOYSA-N
MW198.33 g/mol
LogP2.68
Rot. Bonds2

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

N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine (PubChem CID 165376869) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine
PubChem CID165376869
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC NameN,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine
SMILESCc1ncc(CN(C)C(C)(C)C)s1
InChIInChI=1S/C10H18N2S/c1-8-11-6-9(13-8)7-12(5)10(2,3)4/h6H,7H2,1-5H3
InChIKeyDSRCMWOGDWNTHD-UHFFFAOYSA-N
XLogP2.68
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]propanoic acid
CID 63021521
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]prop-2-enamide
CID 60949049
(2-methyl-1,3-thiazol-5-yl)methanethiol
CID 82514756
2-N,2-N,2-trimethyl-1-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propane-1,2-diamine
CID 60777467
1,1-dimethyl-2-[(2-methyl-1,3-thiazol-5-yl)methyl]hydrazine
CID 83003423
2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide
CID 62489621
5-(bromomethyl)-2-methyl-1,3-thiazole
CID 55250786
2-bromo-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propanamide
CID 107904478
2,2,2-trifluoroethyl N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]carbamate
CID 61067669
2-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]-1,3-thiazol-4-ol
CID 131098085
ethyl 3-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]amino]propanoate
CID 61372216
2-[methyl-[(2-methyl-1,3-thiazol-5-yl)methyl]sulfamoyl]acetic acid
CID 60951190

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine?
The IUPAC name of N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine (CID 165376869) is N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine.
What is the SMILES notation for N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine?
The canonical SMILES for N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine is Cc1ncc(CN(C)C(C)(C)C)s1.
What is the InChIKey of N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine?
The InChIKey is DSRCMWOGDWNTHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-8-11-6-9(13-8)7-12(5)10(2,3)4/h6H,7H2,1-5H3.
What are the key properties of N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine?
N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine has a molecular weight of 198.33 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]propan-2-amine is sourced from PubChem (CID 165376869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).