4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine

C12H23N3S — CID 62765690

IUPAC4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine
SMILESCCCN(CCC)c1nc(C)c(CNC)s1
InChIInChI=1S/C12H23N3S/c1-5-7-15(8-6-2)12-14-10(3)11(16-12)9-13-4/h13H,5-9H2,1-4H3
InChIKeySBIVHANEJALZOK-UHFFFAOYSA-N
MW241.40 g/mol
LogP2.80
Rot. Bonds7

About 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine

4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine (PubChem CID 62765690) has the molecular formula C12H23N3S and a molecular weight of 241.40 g/mol. Its IUPAC name is 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine
PubChem CID62765690
Molecular FormulaC12H23N3S
Molecular Weight241.40 g/mol
Exact Mass241.16
IUPAC Name4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine
SMILESCCCN(CCC)c1nc(C)c(CNC)s1
InChIInChI=1S/C12H23N3S/c1-5-7-15(8-6-2)12-14-10(3)11(16-12)9-13-4/h13H,5-9H2,1-4H3
InChIKeySBIVHANEJALZOK-UHFFFAOYSA-N
XLogP2.80
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.40
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-N'-[4-methyl-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-yl]-N'-propylethane-1,2-diamine
CID 62766864
N'-[5-[(tert-butylamino)methyl]-4-methyl-1,3-thiazol-2-yl]-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 62766866
N,N-dimethyl-N'-[4-methyl-5-[(2-methylpropylamino)methyl]-1,3-thiazol-2-yl]-N'-propylethane-1,2-diamine
CID 62766692
N,N-dimethyl-N'-[5-(methylaminomethyl)-4-propyl-1,3-thiazol-2-yl]-N'-propylethane-1,2-diamine
CID 62767038
4-methyl-N-propyl-5-(propylaminomethyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 62768369
N-ethyl-4-(methoxymethyl)-5-(methylaminomethyl)-N-propyl-1,3-thiazol-2-amine
CID 107509684
5-(methylaminomethyl)-4-propan-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
CID 79392791
N,4-dimethyl-5-(methylaminomethyl)-N-(2-propan-2-yloxyethyl)-1,3-thiazol-2-amine
CID 81067225
N,N-bis(2-methoxyethyl)-5-(methylaminomethyl)-4-propyl-1,3-thiazol-2-amine
CID 62768441
4-tert-butyl-N-(cyclopropylmethyl)-5-(methylaminomethyl)-N-propyl-1,3-thiazol-2-amine
CID 62767699
5-(ethylaminomethyl)-N,N,4-tripropyl-1,3-thiazol-2-amine
CID 55112998
N,4-dimethyl-5-(methylaminomethyl)-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
CID 62766787

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine (CID 62765690) is 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine is CCCN(CCC)c1nc(C)c(CNC)s1.
What is the InChIKey of 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine?
The InChIKey is SBIVHANEJALZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3S/c1-5-7-15(8-6-2)12-14-10(3)11(16-12)9-13-4/h13H,5-9H2,1-4H3.
What are the key properties of 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine?
4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine has a molecular weight of 241.40 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(methylaminomethyl)-N,N-dipropyl-1,3-thiazol-2-amine is sourced from PubChem (CID 62765690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).