5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine

C14H25N3OS — CID 82754568

IUPAC5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
SMILESCCC(C)c1nc(N(C)C2CCOC2C)sc1CN
InChIInChI=1S/C14H25N3OS/c1-5-9(2)13-12(8-15)19-14(16-13)17(4)11-6-7-18-10(11)3/h9-11H,5-8,15H2,1-4H3
InChIKeySUJBWDKKQHJAMF-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.73
Rot. Bonds5

About 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine

5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine (PubChem CID 82754568) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
PubChem CID82754568
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC Name5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
SMILESCCC(C)c1nc(N(C)C2CCOC2C)sc1CN
InChIInChI=1S/C14H25N3OS/c1-5-9(2)13-12(8-15)19-14(16-13)17(4)11-6-7-18-10(11)3/h9-11H,5-8,15H2,1-4H3
InChIKeySUJBWDKKQHJAMF-UHFFFAOYSA-N
XLogP2.73
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

N-methyl-N-(2-methyloxolan-3-yl)-5-[(propan-2-ylamino)methyl]-4-propyl-1,3-thiazol-2-amine
CID 82734715
1-[4-methyl-2-[methyl-(2-methyloxolan-3-yl)amino]-1,3-thiazol-5-yl]ethanol
CID 82754565
4-ethyl-N-methyl-N-(2-methyloxolan-3-yl)-5-(propylaminomethyl)-1,3-thiazol-2-amine
CID 82754026
5-(aminomethyl)-N-cycloheptyl-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine
CID 79396354
4-chloro-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
CID 83157100
4-[1-(ethylamino)ethyl]-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
CID 82753671
2-N-methyl-2-N-(2-methyloxolan-3-yl)-1,3-benzothiazole-2,6-diamine
CID 82741392
N-methyl-5-[1-(methylamino)ethyl]-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine
CID 82754018
2-N-methyl-2-N-(2-methyloxolan-3-yl)pentane-2,3-diamine
CID 82734283
ethyl 2-[2-[methyl-(2-methyloxolan-3-yl)amino]-1,3-thiazol-4-yl]acetate
CID 82745640
4-cyclopropyl-2-[methyl-(2-methyloxolan-3-yl)amino]-1,3-thiazole-5-carbaldehyde
CID 82753674
2-[methyl-(2-methyloxolan-3-yl)amino]-4,5,6,7-tetrahydro-1,3-benzothiazol-7-ol
CID 82754742

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine (CID 82754568) is 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine is CCC(C)c1nc(N(C)C2CCOC2C)sc1CN.
What is the InChIKey of 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
The InChIKey is SUJBWDKKQHJAMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-5-9(2)13-12(8-15)19-14(16-13)17(4)11-6-7-18-10(11)3/h9-11H,5-8,15H2,1-4H3.
What are the key properties of 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine?
5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine has a molecular weight of 283.44 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-4-butan-2-yl-N-methyl-N-(2-methyloxolan-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 82754568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).