1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine

C14H24N2S — CID 113490150

IUPAC1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine
SMILESCCCNC(C)(CC1CCC1)c1nc(C)cs1
InChIInChI=1S/C14H24N2S/c1-4-8-15-14(3,9-12-6-5-7-12)13-16-11(2)10-17-13/h10,12,15H,4-9H2,1-3H3
InChIKeyUBDZDNSXWJOMAO-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.86
Rot. Bonds6

About 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine

1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine (PubChem CID 113490150) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine
PubChem CID113490150
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine
SMILESCCCNC(C)(CC1CCC1)c1nc(C)cs1
InChIInChI=1S/C14H24N2S/c1-4-8-15-14(3,9-12-6-5-7-12)13-16-11(2)10-17-13/h10,12,15H,4-9H2,1-3H3
InChIKeyUBDZDNSXWJOMAO-UHFFFAOYSA-N
XLogP3.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylpropan-2-amine
CID 113490154
1-cyclopropyl-1-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-1-amine
CID 64917236
(2R)-2-(4-methyl-1,3-thiazol-2-yl)-N-[2-[(2R)-oxan-2-yl]ethyl]butan-2-amine
CID 99777451
(2R)-1-cyclopropyl-2-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 124679641
3-methyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpentan-2-amine
CID 61332999
3-[[(2R)-2-(4-methyl-1,3-thiazol-2-yl)butan-2-yl]amino]propan-1-ol
CID 95903874
N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)heptan-2-amine
CID 80558853
1-cyclobutyl-1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine
CID 130703480
N-ethyl-2-(4-methyl-1,3-thiazol-2-yl)octan-2-amine
CID 61330206
3-(4-methyl-1,3-thiazol-2-yl)-N-propylheptan-3-amine
CID 63951458
N-[1-cyclopentyl-1-(4-methyl-1,3-thiazol-2-yl)ethyl]cyclopropanamine
CID 55096963
2-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylbutan-2-amine
CID 61335180

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine?
The IUPAC name of 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine (CID 113490150) is 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine.
What is the SMILES notation for 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine?
The canonical SMILES for 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine is CCCNC(C)(CC1CCC1)c1nc(C)cs1.
What is the InChIKey of 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine?
The InChIKey is UBDZDNSXWJOMAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-4-8-15-14(3,9-12-6-5-7-12)13-16-11(2)10-17-13/h10,12,15H,4-9H2,1-3H3.
What are the key properties of 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine?
1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine has a molecular weight of 252.43 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-(4-methyl-1,3-thiazol-2-yl)-N-propylpropan-2-amine is sourced from PubChem (CID 113490150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).