5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine

C15H27N3S — CID 64907380

IUPAC5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1ncc(CNC2CCC(C)C2C)s1
InChIInChI=1S/C15H27N3S/c1-5-18(6-2)15-17-10-13(19-15)9-16-14-8-7-11(3)12(14)4/h10-12,14,16H,5-9H2,1-4H3
InChIKeyFWDYAYFQLLZSLH-UHFFFAOYSA-N
MW281.47 g/mol
LogP3.51
Rot. Bonds6

About 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine

5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine (PubChem CID 64907380) has the molecular formula C15H27N3S and a molecular weight of 281.47 g/mol. Its IUPAC name is 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine
PubChem CID64907380
Molecular FormulaC15H27N3S
Molecular Weight281.47 g/mol
Exact Mass281.19
IUPAC Name5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1ncc(CNC2CCC(C)C2C)s1
InChIInChI=1S/C15H27N3S/c1-5-18(6-2)15-17-10-13(19-15)9-16-14-8-7-11(3)12(14)4/h10-12,14,16H,5-9H2,1-4H3
InChIKeyFWDYAYFQLLZSLH-UHFFFAOYSA-N
XLogP3.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[(2,6-dimethylpiperidin-1-yl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine
CID 83010249
N,N-diethyl-5-[(oxan-4-ylamino)methyl]-1,3-thiazol-2-amine
CID 43778486
N,N-diethyl-5-[(thiolan-3-ylamino)methyl]-1,3-thiazol-2-amine
CID 103701514
N,N-diethyl-5-[[(2-methyloxan-4-yl)amino]methyl]-1,3-thiazol-2-amine
CID 103887950
N,N-diethyl-5-[[(4-propylcyclohexyl)amino]methyl]-1,3-thiazol-2-amine
CID 63454816
5-[[(2,2-dimethylcyclohexyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine
CID 79861333
N,N-diethyl-5-[[(1-methylpiperidin-3-yl)amino]methyl]-1,3-thiazol-2-amine
CID 61211415
5-[(cyclopropylamino)methyl]-N-ethyl-N-(2-ethylbutyl)-1,3-thiazol-2-amine
CID 62755153
N-[(5-ethylthiophen-2-yl)methyl]-2,3-dimethylcyclopentan-1-amine
CID 64909543
5-[(cyclopropylamino)methyl]-N-ethyl-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 62753260
(1S,2R)-1-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]-2,3-dihydro-1H-inden-2-ol
CID 110923337
4-[[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]methyl]cyclohexan-1-ol
CID 106124874

Frequently Asked Questions

What is the IUPAC name of 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine (CID 64907380) is 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine is CCN(CC)c1ncc(CNC2CCC(C)C2C)s1.
What is the InChIKey of 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine?
The InChIKey is FWDYAYFQLLZSLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3S/c1-5-18(6-2)15-17-10-13(19-15)9-16-14-8-7-11(3)12(14)4/h10-12,14,16H,5-9H2,1-4H3.
What are the key properties of 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine?
5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine has a molecular weight of 281.47 g/mol, XLogP of 3.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(2,3-dimethylcyclopentyl)amino]methyl]-N,N-diethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 64907380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).