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

C14H25N3S — CID 62977359

IUPAC3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine
SMILESCCc1nc(C2(NC(C)C)CCN(C)C2)sc1C
InChIInChI=1S/C14H25N3S/c1-6-12-11(4)18-13(15-12)14(16-10(2)3)7-8-17(5)9-14/h10,16H,6-9H2,1-5H3
InChIKeyDTNXBKDGOKSZFL-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.54
Rot. Bonds4

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

3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine (PubChem CID 62977359) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine
PubChem CID62977359
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine
SMILESCCc1nc(C2(NC(C)C)CCN(C)C2)sc1C
InChIInChI=1S/C14H25N3S/c1-6-12-11(4)18-13(15-12)14(16-10(2)3)7-8-17(5)9-14/h10,16H,6-9H2,1-5H3
InChIKeyDTNXBKDGOKSZFL-UHFFFAOYSA-N
XLogP2.54
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine (CID 62977359) is 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine is CCc1nc(C2(NC(C)C)CCN(C)C2)sc1C.
What is the InChIKey of 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine?
The InChIKey is DTNXBKDGOKSZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-6-12-11(4)18-13(15-12)14(16-10(2)3)7-8-17(5)9-14/h10,16H,6-9H2,1-5H3.
What are the key properties of 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine?
3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine has a molecular weight of 267.44 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 62977359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).