5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine

C14H25N3S — CID 107164685

IUPAC5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESCN1CCC(C)(CNC2=NCC(C3CC3)S2)CC1
InChIInChI=1S/C14H25N3S/c1-14(5-7-17(2)8-6-14)10-16-13-15-9-12(18-13)11-3-4-11/h11-12H,3-10H2,1-2H3,(H,15,16)
InChIKeyDQTAREZFQHJJMU-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.19
Rot. Bonds3

About 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine

5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 107164685) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID107164685
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
SMILESCN1CCC(C)(CNC2=NCC(C3CC3)S2)CC1
InChIInChI=1S/C14H25N3S/c1-14(5-7-17(2)8-6-14)10-16-13-15-9-12(18-13)11-3-4-11/h11-12H,3-10H2,1-2H3,(H,15,16)
InChIKeyDQTAREZFQHJJMU-UHFFFAOYSA-N
XLogP2.19
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine (CID 107164685) is 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine is CN1CCC(C)(CNC2=NCC(C3CC3)S2)CC1.
What is the InChIKey of 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is DQTAREZFQHJJMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-14(5-7-17(2)8-6-14)10-16-13-15-9-12(18-13)11-3-4-11/h11-12H,3-10H2,1-2H3,(H,15,16).
What are the key properties of 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine?
5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 267.44 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 107164685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).