N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine

C11H19N3S — CID 81467519

IUPACN,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine
SMILESCNC1(c2nc(C)cs2)CC(C)N(C)C1
InChIInChI=1S/C11H19N3S/c1-8-6-15-10(13-8)11(12-3)5-9(2)14(4)7-11/h6,9,12H,5,7H2,1-4H3
InChIKeyYGKTWEWSEUQILM-UHFFFAOYSA-N
MW225.36 g/mol
LogP1.59
Rot. Bonds2

About N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine

N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine (PubChem CID 81467519) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine
PubChem CID81467519
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC NameN,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine
SMILESCNC1(c2nc(C)cs2)CC(C)N(C)C1
InChIInChI=1S/C11H19N3S/c1-8-6-15-10(13-8)11(12-3)5-9(2)14(4)7-11/h6,9,12H,5,7H2,1-4H3
InChIKeyYGKTWEWSEUQILM-UHFFFAOYSA-N
XLogP1.59
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(4-methyl-1,3-thiazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 64754919
N-ethyl-3-methoxy-1-(4-methyl-1,3-thiazol-2-yl)cyclobutan-1-amine
CID 106823127
N-(2-methoxyethyl)-3,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)cyclohexan-1-amine
CID 64751515
3-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine
CID 64515479
6-bromo-N-methyl-2-(4-methyl-1,3-thiazol-2-yl)-3,4-dihydro-1H-naphthalen-2-amine
CID 63630641
3-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propylcyclopentan-1-amine
CID 64514285
7-methoxy-N-methyl-2-(4-methyl-1,3-thiazol-2-yl)-3,4-dihydro-1H-naphthalen-2-amine
CID 115510891
N-cyclopropyl-1-(4-methyl-1,3-thiazol-2-yl)cyclooctan-1-amine
CID 61335254
N-cyclopropyl-1-methyl-4-(4-methyl-1,3-thiazol-2-yl)azepan-4-amine
CID 65074762
4-methyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcycloheptan-1-amine
CID 65084804
1-(4-tert-butyl-1,3-thiazol-2-yl)-N,3,5-trimethylcyclohexan-1-amine
CID 64753474
N-ethyl-4-methyl-1-(4-methyl-1,3-thiazol-2-yl)cycloheptan-1-amine
CID 65085428

Frequently Asked Questions

What is the IUPAC name of N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine?
The IUPAC name of N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine (CID 81467519) is N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine?
The canonical SMILES for N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine is CNC1(c2nc(C)cs2)CC(C)N(C)C1.
What is the InChIKey of N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine?
The InChIKey is YGKTWEWSEUQILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-8-6-15-10(13-8)11(12-3)5-9(2)14(4)7-11/h6,9,12H,5,7H2,1-4H3.
What are the key properties of N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine?
N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine has a molecular weight of 225.36 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,5-trimethyl-3-(4-methyl-1,3-thiazol-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 81467519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).