N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine

C12H21N3S — CID 15329642

IUPACN,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nc(N2CCCCC2)cs1
InChIInChI=1S/C12H21N3S/c1-3-14(4-2)12-13-11(10-16-12)15-8-6-5-7-9-15/h10H,3-9H2,1-2H3
InChIKeyNYWQIAKIGWENLA-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.98
Rot. Bonds4

About N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine

N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine (PubChem CID 15329642) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine
PubChem CID15329642
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC NameN,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nc(N2CCCCC2)cs1
InChIInChI=1S/C12H21N3S/c1-3-14(4-2)12-13-11(10-16-12)15-8-6-5-7-9-15/h10H,3-9H2,1-2H3
InChIKeyNYWQIAKIGWENLA-UHFFFAOYSA-N
XLogP2.98
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine?
The IUPAC name of N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine (CID 15329642) is N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine?
The canonical SMILES for N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine is CCN(CC)c1nc(N2CCCCC2)cs1.
What is the InChIKey of N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine?
The InChIKey is NYWQIAKIGWENLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-3-14(4-2)12-13-11(10-16-12)15-8-6-5-7-9-15/h10H,3-9H2,1-2H3.
What are the key properties of N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine?
N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine has a molecular weight of 239.39 g/mol, XLogP of 2.98, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-piperidin-1-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 15329642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).