[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol

C14H24N2OS — CID 63915868

IUPAC[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol
SMILESCC(C)CC(C)N(C)c1nc(C2CC2)c(CO)s1
InChIInChI=1S/C14H24N2OS/c1-9(2)7-10(3)16(4)14-15-13(11-5-6-11)12(8-17)18-14/h9-11,17H,5-8H2,1-4H3
InChIKeyPEZWHJUWININRX-UHFFFAOYSA-N
MW268.43 g/mol
LogP3.38
Rot. Bonds6

About [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol

[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 63915868) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID63915868
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol
SMILESCC(C)CC(C)N(C)c1nc(C2CC2)c(CO)s1
InChIInChI=1S/C14H24N2OS/c1-9(2)7-10(3)16(4)14-15-13(11-5-6-11)12(8-17)18-14/h9-11,17H,5-8H2,1-4H3
InChIKeyPEZWHJUWININRX-UHFFFAOYSA-N
XLogP3.38
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopropyl-5-(ethylaminomethyl)-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazol-2-amine
CID 63918356
[4-cyclopropyl-2-[methyl(3-methylbutyl)amino]-1,3-thiazol-5-yl]methanol
CID 63917237
4-cyclopropyl-5-(ethylaminomethyl)-N-methyl-N-pentan-2-yl-1,3-thiazol-2-amine
CID 63918125
[4-cyclopropyl-2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol
CID 63917040
[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol
CID 63918393
[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol
CID 63916638
4-cyclopropyl-N-methyl-N-(1-methylsulfanylpropan-2-yl)-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 115987992
[4-cyclopropyl-2-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]-1,3-thiazol-5-yl]methanol
CID 63915678
5-(aminomethyl)-4-cyclopropyl-N,N-dimethyl-1,3-thiazol-2-amine
CID 63916162
(2-bromo-4-cyclopropyl-1,3-thiazol-5-yl)methanol
CID 142609313
5-(ethylaminomethyl)-N-methyl-N-(4-methylpentan-2-yl)-4-propan-2-yl-1,3-thiazol-2-amine
CID 79392937
4-cyclopropyl-N-methyl-N-(3-methylbutan-2-yl)-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 63916185

Frequently Asked Questions

What is the IUPAC name of [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol (CID 63915868) is [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol is CC(C)CC(C)N(C)c1nc(C2CC2)c(CO)s1.
What is the InChIKey of [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is PEZWHJUWININRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-9(2)7-10(3)16(4)14-15-13(11-5-6-11)12(8-17)18-14/h9-11,17H,5-8H2,1-4H3.
What are the key properties of [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol?
[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 268.43 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63915868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).