(2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine

C16H19N3S — CID 67144836

IUPAC(2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine
SMILESCN(C)C1S[C@H](c2ccccn2)N[C@H]1c1ccccc1
InChIInChI=1S/C16H19N3S/c1-19(2)16-14(12-8-4-3-5-9-12)18-15(20-16)13-10-6-7-11-17-13/h3-11,14-16,18H,1-2H3/t14-,15+,16?/m0/s1
InChIKeyUAOPKDVFQUFKSU-QMRHZFGWSA-N
MW285.42 g/mol
LogP3.05
Rot. Bonds3

About (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine

(2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine (PubChem CID 67144836) has the molecular formula C16H19N3S and a molecular weight of 285.42 g/mol. Its IUPAC name is (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine.

Molecular Properties

Compound Name(2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine
PubChem CID67144836
Molecular FormulaC16H19N3S
Molecular Weight285.42 g/mol
Exact Mass285.13
IUPAC Name(2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine
SMILESCN(C)C1S[C@H](c2ccccn2)N[C@H]1c1ccccc1
InChIInChI=1S/C16H19N3S/c1-19(2)16-14(12-8-4-3-5-9-12)18-15(20-16)13-10-6-7-11-17-13/h3-11,14-16,18H,1-2H3/t14-,15+,16?/m0/s1
InChIKeyUAOPKDVFQUFKSU-QMRHZFGWSA-N
XLogP3.05
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.42
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine?
The IUPAC name of (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine (CID 67144836) is (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine.
What is the SMILES notation for (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine?
The canonical SMILES for (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine is CN(C)C1S[C@H](c2ccccn2)N[C@H]1c1ccccc1.
What is the InChIKey of (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine?
The InChIKey is UAOPKDVFQUFKSU-QMRHZFGWSA-N. The full InChI is InChI=1S/C16H19N3S/c1-19(2)16-14(12-8-4-3-5-9-12)18-15(20-16)13-10-6-7-11-17-13/h3-11,14-16,18H,1-2H3/t14-,15+,16?/m0/s1.
What are the key properties of (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine?
(2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine has a molecular weight of 285.42 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-N,N-dimethyl-4-phenyl-2-pyridin-2-yl-1,3-thiazolidin-5-amine is sourced from PubChem (CID 67144836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).