5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine

C12H23N5S — CID 129059337

IUPAC5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCN(C)C1=NCC(CCN(C)C2=NCCN2)S1
InChIInChI=1S/C12H23N5S/c1-4-16(2)12-15-9-10(18-12)5-8-17(3)11-13-6-7-14-11/h10H,4-9H2,1-3H3,(H,13,14)
InChIKeyYQGFARMNYOQEQD-UHFFFAOYSA-N
MW269.42 g/mol
LogP0.69
Rot. Bonds4

About 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine

5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 129059337) has the molecular formula C12H23N5S and a molecular weight of 269.42 g/mol. Its IUPAC name is 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID129059337
Molecular FormulaC12H23N5S
Molecular Weight269.42 g/mol
Exact Mass269.17
IUPAC Name5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCCN(C)C1=NCC(CCN(C)C2=NCCN2)S1
InChIInChI=1S/C12H23N5S/c1-4-16(2)12-15-9-10(18-12)5-8-17(3)11-13-6-7-14-11/h10H,4-9H2,1-3H3,(H,13,14)
InChIKeyYQGFARMNYOQEQD-UHFFFAOYSA-N
XLogP0.69
TPSA43.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.42
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine with MolForge

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Related Compounds

2-Imidazoline, 2-(3-trimethylaminopropylthio)-, dihydrobromide
CID 22744
3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)propyl-trimethylazanium
CID 22745
Usaf IN-9
CID 24185788
3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N,N-dimethylpropan-1-amine
CID 13018876
3-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N,N-dimethylpropan-1-amine;dihydrochloride
CID 13018877
4-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N,N-dimethylbutan-1-amine
CID 20213259
2-N-(3-methylsulfanylpropyl)-4,5-dihydro-1H-imidazole-2,5-diamine
CID 68852465
N-[2-[2-[ethyl(methyl)amino]-4,5-dihydro-1H-imidazol-5-yl]ethyl]-N-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 129059236
N-[(2-methylimino-1,3-thiazolidin-5-yl)methyl]-4,5-dihydro-1H-imidazol-2-amine
CID 163702799
4-[2-(4,5-dihydro-1H-imidazol-2-ylamino)propyl]-N-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 166731233
1-(2-Aminoethyl)-3-cyano-1-methyl-2-(3-methylsulfanylpropyl)guanidine
CID 167267494
2-(3-pyrrolidin-1-ylpropylsulfanyl)-4,5-dihydro-1H-imidazole
CID 169004918

Frequently Asked Questions

What is the IUPAC name of 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine (CID 129059337) is 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine is CCN(C)C1=NCC(CCN(C)C2=NCCN2)S1.
What is the InChIKey of 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is YQGFARMNYOQEQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5S/c1-4-16(2)12-15-9-10(18-12)5-8-17(3)11-13-6-7-14-11/h10H,4-9H2,1-3H3,(H,13,14).
What are the key properties of 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine?
5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 269.42 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[4,5-dihydro-1H-imidazol-2-yl(methyl)amino]ethyl]-N-ethyl-N-methyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 129059337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).