(E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine

C10H16N2OS — CID 103392227

IUPAC(E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine
SMILESCOC/C(=C/c1nccs1)CCCN
InChIInChI=1S/C10H16N2OS/c1-13-8-9(3-2-4-11)7-10-12-5-6-14-10/h5-7H,2-4,8,11H2,1H3/b9-7+
InChIKeyMURIFCUWBHBKAK-VQHVLOKHSA-N
MW212.32 g/mol
LogP1.91
Rot. Bonds6

About (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine

(E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine (PubChem CID 103392227) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine.

Molecular Properties

Compound Name(E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine
PubChem CID103392227
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name(E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine
SMILESCOC/C(=C/c1nccs1)CCCN
InChIInChI=1S/C10H16N2OS/c1-13-8-9(3-2-4-11)7-10-12-5-6-14-10/h5-7H,2-4,8,11H2,1H3/b9-7+
InChIKeyMURIFCUWBHBKAK-VQHVLOKHSA-N
XLogP1.91
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(E)-4-(methoxymethyl)-6-thiophen-3-ylhex-4-en-1-amine
CID 103392141
(E)-5-(3-fluorophenyl)-4-(methoxymethyl)pent-4-en-1-amine
CID 103392189
4-(methoxymethyl)-6-methylhept-4-en-1-amine
CID 103392068
2-ethoxy-1-(1,3-thiazol-2-yl)hex-1-en-3-one
CID 175911040
(4E)-4-(methoxymethyl)nona-4,8-dien-1-amine
CID 103392193
4-amino-N-(1,3-thiazol-2-yl)butanamide;hydrochloride
CID 168719847
(Z)-4-(methoxymethyl)undec-4-en-1-amine
CID 103392101
(Z)-2-amino-3-(1,3-thiazol-2-yl)prop-2-enoic acid
CID 70407075
4-(methoxymethyl)non-4-en-8-yn-1-amine
CID 103392158
4-fluoro-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pentan-1-amine
CID 103392378
ethane;(Z)-2-(1,3-thiazol-2-yl)ethenamine
CID 166455841
4-amino-N-[2-(1,3-thiazol-2-yl)butan-2-yl]butanamide;dihydrochloride
CID 119892442

Frequently Asked Questions

What is the IUPAC name of (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine?
The IUPAC name of (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine (CID 103392227) is (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine.
What is the SMILES notation for (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine?
The canonical SMILES for (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine is COC/C(=C/c1nccs1)CCCN.
What is the InChIKey of (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine?
The InChIKey is MURIFCUWBHBKAK-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-13-8-9(3-2-4-11)7-10-12-5-6-14-10/h5-7H,2-4,8,11H2,1H3/b9-7+.
What are the key properties of (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine?
(E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine has a molecular weight of 212.32 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-(methoxymethyl)-5-(1,3-thiazol-2-yl)pent-4-en-1-amine is sourced from PubChem (CID 103392227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).