N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine

C14H23N5S — CID 93294400

IUPACN,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine
SMILESCCN(CC)c1ncc(CN[C@H](C)Cn2cccn2)s1
InChIInChI=1S/C14H23N5S/c1-4-18(5-2)14-16-10-13(20-14)9-15-12(3)11-19-8-6-7-17-19/h6-8,10,12,15H,4-5,9,11H2,1-3H3/t12-/m1/s1
InChIKeyXQDNTSKJBAWQFX-GFCCVEGCSA-N
MW293.44 g/mol
LogP2.36
Rot. Bonds8

About N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine

N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine (PubChem CID 93294400) has the molecular formula C14H23N5S and a molecular weight of 293.44 g/mol. Its IUPAC name is N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine
PubChem CID93294400
Molecular FormulaC14H23N5S
Molecular Weight293.44 g/mol
Exact Mass293.17
IUPAC NameN,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine
SMILESCCN(CC)c1ncc(CN[C@H](C)Cn2cccn2)s1
InChIInChI=1S/C14H23N5S/c1-4-18(5-2)14-16-10-13(20-14)9-15-12(3)11-19-8-6-7-17-19/h6-8,10,12,15H,4-5,9,11H2,1-3H3/t12-/m1/s1
InChIKeyXQDNTSKJBAWQFX-GFCCVEGCSA-N
XLogP2.36
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine with MolForge

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Related Compounds

N,N-diethyl-5-[(5-methylhexan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 43767177
3-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]butanamide
CID 115870437
N,N-diethyl-5-[(1-pyridin-4-ylethylamino)methyl]-1,3-thiazol-2-amine
CID 43766835
2-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]propanoic acid
CID 54959823
2-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]butan-1-ol
CID 43771096
N-(pyrazin-2-ylmethyl)-1-pyrazol-1-ylpropan-2-amine
CID 62761307
3-[[2-(diethylamino)-1,3-thiazol-5-yl]methylamino]-3-methylbutan-2-ol
CID 113342046
N-ethyl-1-pyrazol-1-ylpropan-2-amine
CID 43435880
4-methoxy-N,N-dimethyl-5-[(1-pyrazol-1-ylpropan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 43749414
5-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]methyl]-N,N-diethyl-1,3-thiazol-2-amine
CID 78961443
N-ethyl-5-(ethylaminomethyl)-N-(2-methylbutyl)-1,3-thiazol-2-amine
CID 79482761
N-[[2-(diethylamino)-1,3-thiazol-5-yl]methyl]-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 43757506

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine?
The IUPAC name of N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine (CID 93294400) is N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine?
The canonical SMILES for N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine is CCN(CC)c1ncc(CN[C@H](C)Cn2cccn2)s1.
What is the InChIKey of N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine?
The InChIKey is XQDNTSKJBAWQFX-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H23N5S/c1-4-18(5-2)14-16-10-13(20-14)9-15-12(3)11-19-8-6-7-17-19/h6-8,10,12,15H,4-5,9,11H2,1-3H3/t12-/m1/s1.
What are the key properties of N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine?
N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine has a molecular weight of 293.44 g/mol, XLogP of 2.36, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-[[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 93294400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).