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

C14H25N3S — CID 61331152

IUPAC1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine
SMILESCCN1CCC(NC)(c2nc(C(C)C)cs2)CC1
InChIInChI=1S/C14H25N3S/c1-5-17-8-6-14(15-4,7-9-17)13-16-12(10-18-13)11(2)3/h10-11,15H,5-9H2,1-4H3
InChIKeyPYOFEQSWDYVWGY-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.80
Rot. Bonds4

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

1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine (PubChem CID 61331152) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine
PubChem CID61331152
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine
SMILESCCN1CCC(NC)(c2nc(C(C)C)cs2)CC1
InChIInChI=1S/C14H25N3S/c1-5-17-8-6-14(15-4,7-9-17)13-16-12(10-18-13)11(2)3/h10-11,15H,5-9H2,1-4H3
InChIKeyPYOFEQSWDYVWGY-UHFFFAOYSA-N
XLogP2.80
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 ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
The IUPAC name of 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine (CID 61331152) is 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine is CCN1CCC(NC)(c2nc(C(C)C)cs2)CC1.
What is the InChIKey of 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
The InChIKey is PYOFEQSWDYVWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-5-17-8-6-14(15-4,7-9-17)13-16-12(10-18-13)11(2)3/h10-11,15H,5-9H2,1-4H3.
What are the key properties of 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine?
1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine has a molecular weight of 267.44 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-methyl-4-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-4-amine is sourced from PubChem (CID 61331152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).